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Sample records for cr mn fe

  1. Eutectic equilibria in the quaternary system Fe-Cr-Mn-C

    NASA Technical Reports Server (NTRS)

    Nowotny, H.; Wayne, S.; Schuster, J. C.

    1982-01-01

    The constitution of the quaternary system, Fe-Cr-Mn-C and to a lesser extent of the quinary system, Fe-Cr-Mn-Al-C were examined for in situ composite alloy candidates. Multivariant eutectic compositions were determined from phase equilibria studies wherein M7C3 carbides (approximately 30% by volume) formed from the melt within gamma iron. An extended field of the hexagonal carbide, (Cr, Fe, Mn)7 C3, was found without undergoing transformation to the orthorhombic structure. Increasing stability for this carbide was found for higher ratios of Cr/Fe(+) Cr + Mn. Aluminum additions promoted a ferritic matrix while manganese favored the desired gamma austenitic matrix. In coexistence with the matrix phase, chromium enters preferentially the carbide phase while manganese distributes equally between the gamma matrix and the M7C3 carbide. The composition and lattice parameters of the carbide and matrix phases were determined to establish their respective stabilities.

  2. Variation in the structural and magnetic properties of heterovalent Mn2+-Si4+ substituted MnCrFeO nanoparticles

    NASA Astrophysics Data System (ADS)

    Kadam, R. H.; Desai, Kirti; Kadam, Supriya R.; Shirsath, Sagar E.

    2013-12-01

    We have synthesized heterovalent Mn2+-Si4+ substituted MnCrFeO nanoparticles with a nominal composition Mn1+xSixCrFe1-2xO4 (x = 0.0-0.3) via sol-gel auto-combustion method. X-ray diffractometer, transmission electron microscopy, magnetization measurements were used to study the effects of Mn2+-Si4+ heterovalent ions on the structural and magnetic properties of MnCrFeO. As a result, it was found that the Mn2+-Si4+ ions affect the crystalline structures and magnetic properties of MnCrFeO. X-ray diffraction pattern showed that the samples have the single phase cubic spinel structure of which the lattice constant slightly increased upon Mn2+-Si4+ substitution. The mean crystallite size of the samples was in the range of 21-27 nm as deduced from the XRD line broadening. Cation distribution was estimated using XRD data and it shows that Mn2+ and Si4+ ions prefer tetrahedral A-site. Magnetic measurement shows that saturation magnetization and magneton number decreased with Mn2+-Si4+ substitution with the formation of a collinear spin arrangement.

  3. Corrosion of Fe-Cr-Mn alloys in thermally convective lithium

    SciTech Connect

    Tortorelli, P.F.; DeVan, J.H.

    1986-01-01

    A series of austenitic Fe-Cr-Mn steels was exposed to circulating lithium at temperatures up to 500/sup 0/C. Two groups of the alloys, which contained 12 to 30 wt % Mn and 2 to 20 wt % Cr, were sequentially exposed for periods greater than 3000 h in a type 316 stainless steel thermal convection loop. Mass transfer of manganese caused very large weight losses from the steels containing 30 wt % Mn. However, the actual magnitude of corrosion losses for alloys containing 12 to 20 wt % Mn was difficult to establish due to competing surface reactions involving chromium.

  4. Mn-Fe base and Mn-Cr-Fe base austenitic alloys

    DOEpatents

    Brager, Howard R.; Garner, Francis A.

    1987-09-01

    Manganese-iron base and manganese-chromium-iron base austenitic alloys designed to have resistance to neutron irradiation induced swelling and low activation have the following compositions (in weight percent): 20 to 40 Mn; up to about 15 Cr; about 0.4 to about 3.0 Si; an austenite stabilizing element selected from C and N, alone or in combination with each other, and in an amount effective to substantially stabilize the austenite phase, but less than about 0.7 C, and less than about 0.3 N; up to about 2.5 V; up to about 0.1 P; up to about 0.01 B; up to about 3.0 Al; up to about 0.5 Ni; up to about 2.0 W; up to about 1.0 Ti; up to about 1.0 Ta; and with the remainder of the alloy being essentially iron.

  5. Mn-Fe base and Mn-Cr-Fe base austenitic alloys

    DOEpatents

    Brager, Howard R.; Garner, Francis A.

    1987-01-01

    Manganese-iron base and manganese-chromium-iron base austenitic alloys designed to have resistance to neutron irradiation induced swelling and low activation have the following compositions (in weight percent): 20 to 40 Mn; up to about 15 Cr; about 0.4 to about 3.0 Si; an austenite stabilizing element selected from C and N, alone or in combination with each other, and in an amount effective to substantially stabilize the austenite phase, but less than about 0.7 C, and less than about 0.3 N; up to about 2.5 V; up to about 0.1 P; up to about 0.01 B; up to about 3.0 Al; up to about 0.5 Ni; up to about 2.0 W; up to about 1.0 Ti; up to about 1.0 Ta; and with the remainder of the alloy being essentially iron.

  6. Magnetic susceptibilities of liquid Cr-Au, Mn-Au and Fe-Au alloys

    SciTech Connect

    Ohno, S.; Shimakura, H.; Tahara, S.; Okada, T.

    2015-08-17

    The magnetic susceptibility of liquid Cr-Au, Mn-Au, Fe-Au and Cu-Au alloys was investigated as a function of temperature and composition. Liquid Cr{sub 1-c}Au{sub c} with 0.5 ≤ c and Mn{sub 1-c}Au{sub c} with 0.3≤c obeyed the Curie-Weiss law with regard to their dependence of χ on temperature. The magnetic susceptibilities of liquid Fe-Au alloys also exhibited Curie-Weiss behavior with a reasonable value for the effective number of Bohr magneton. On the Au-rich side, the composition dependence of χ for liquid TM-Au (TM=Cr, Mn, Fe) alloys increased rapidly with increasing TM content, respectively. Additionally, the composition dependences of χ for liquid Cr-Au, Mn-Au, and Fe-Au alloys had maxima at compositions of 50 at% Cr, 70 at% Mn, and 85 at% Fe, respectively. We compared the composition dependences of χ{sub 3d} due to 3d electrons for liquid binary TM-M (M=Au, Al, Si, Sb), and investigated the relationship between χ{sub 3d} and E{sub F} in liquid binary TM-M alloys at a composition of 50 at% TM.

  7. Electrochemical deposition and microstructural characterization of AlCrFeMnNi and AlCrCuFeMnNi high entropy alloy thin films

    NASA Astrophysics Data System (ADS)

    Soare, V.; Burada, M.; Constantin, I.; Mitrică, D.; Bădiliţă, V.; Caragea, A.; Târcolea, M.

    2015-12-01

    Al-Cr-Fe-Mn-Ni and Al-Cr-Cu-Fe-Mn-Ni high entropy alloy thin films were prepared by potentiostatic electrodeposition and the microstructure of the deposits was investigated. The thin films were co-deposited in an electrolyte based on a DMF (N,N-dimethylformamide)-CH3CN (acetonitrile) organic compound. The energy dispersive spectrometry investigation (EDS) indicated that all the five respectively six elements were successfully co-deposited. The scanning electron microscopy (SEM) analysis revealed that the film consists of compact and uniform particles with particle sizes of 500 nm to 4 μm. The X-ray diffractometry (XRD) patterns indicated that the as-deposited thin films were amorphous. Body-centered-cubic (BCC) structures were identified by XRD after the films were annealed at various temperatures under inert Ar atmosphere. The alloys adhesion on the substrate was determined by the scratch-testing method, with higher values obtained for the Al-Cr-Cu-Fe-Mn-Ni alloy.

  8. Mechanism and kinetics of interaction of Fe, Cr, Mo, and Mn atoms with molecular oxygen

    SciTech Connect

    Akhmadov, U.S.; Zaslonko, I.S.; Smirnov, V.N.

    1988-09-01

    By means of resonance atomic absorption in shock waves, rate constants have been measured for the interaction of atoms of a number of transition metals (Fe, Cr, Mo, and Mn) with molecular oxygen. A new method is proposed and used for determining the exponent ..gamma.. in the modified Lambert-Beer law D = element of(ZN)/sup ..gamma../. The bond strength in CrO and MoO molecules has been estimated.

  9. Plasma-Sprayed High Entropy Alloys: Microstructure and Properties of AlCoCrFeNi and MnCoCrFeNi

    NASA Astrophysics Data System (ADS)

    Ang, Andrew Siao Ming; Berndt, Christopher C.; Sesso, Mitchell L.; Anupam, Ameey; S, Praveen; Kottada, Ravi Sankar; Murty, B. S.

    2015-02-01

    High entropy alloys (HEAs) represent a new class of materials that present novel phase structures and properties. Apart from bulk material consolidation methods such as casting and sintering, HEAs can also be deposited as a surface coating. In this work, thermal sprayed HEA coatings are investigated that may be used as an alternative bond coat material for a thermal barrier coating system. Nanostructured HEAs that were based on AlCoCrFeNi and MnCoCrFeNi were prepared by ball milling and then plasma sprayed. Splat studies were assessed to optimise the appropriate thermal spray parameters and spray deposits were prepared. After mechanical alloying, aluminum-based and manganese-based HEA powders revealed contrary prominences of BCC and FCC phases in their X-ray diffraction patterns. However, FCC phase was observed as the major phase present in both of the plasma-sprayed AlCoCrFeNi and MnCoCrFeNi coatings. There were also minor oxide peaks detected, which can be attributed to the high temperature processing. The measured porosity levels for AlCoCrFeNi and MnCoCrFeNi coatings were 9.5 ± 2.3 and 7.4 ± 1.3 pct, respectively. Three distinct phase contrasts, dark gray, light gray and white, were observed in the SEM images, with the white regions corresponding to retained multicomponent HEAs. The Vickers hardness (HV0.3kgf) was 4.13 ± 0.43 and 4.42 ± 0.60 GPa for AlCoCrFeNi and MnCoCrFeNi, respectively. Both type of HEAs coatings exhibited anisotropic mechanical behavior due to their lamellar, composite-type microstructure.

  10. Mechanical Properties and Microstructure of the CoCrFeMnNi High Entropy Alloy Under High Strain Rate Compression

    NASA Astrophysics Data System (ADS)

    Wang, Bingfeng; Fu, Ao; Huang, Xiaoxia; Liu, Bin; Liu, Yong; Li, Zezhou; Zan, Xiang

    2016-07-01

    The equiatomic CoCrFeMnNi high entropy alloy, which crystallizes in the face-centered cubic (FCC) crystal structure, was prepared by the spark plasma sintering technique. Dynamic compressive tests of the CoCrFeMnNi high entropy alloy were deformed at varying strain rates ranging from 1 × 103 to 3 × 103 s-1 using a split-Hopkinson pressure bar (SHPB) system. The dynamic yield strength of the CoCrFeMnNi high entropy alloy increases with increasing strain rate. The Zerilli-Armstrong (Z-A) plastic model was applied to model the dynamic flow behavior of the CoCrFeMnNi high entropy alloy, and the constitutive relationship was obtained. Serration behavior during plastic deformation was observed in the stress-strain curves. The mechanism for serration behavior of the alloy deformed at high strain rate is proposed.

  11. Further Observations of Fe-60-Ni-60 and Mn-53-Cr-53 Isotopic Systems in Sulfides from Enstatite Chondrites

    NASA Technical Reports Server (NTRS)

    Guan, Y.; Huss, G. R.; Leshin, L. A.

    2004-01-01

    Recent studies have shown that short-lived Fe-60 (t(sub 1/2) = 1.5 Ma) was present in some components of ordinary and enstatite chondrites when they formed. Here we report additional data on Fe-60 from sulfides in enstatite chondrites and on the potential relationship between the Fe-60-Ni-60 and Mn-53-Cr-53 systems.

  12. Redox Dynamics of Mixed Metal (Mn, Cr, and Fe) Ultrafine Particles

    PubMed Central

    Nico, Peter S.; Kumfer, Benjamin M.; Kennedy, Ian M.; Anastasio, Cort

    2008-01-01

    The impact of particle composition on metal oxidation state, and on changes in oxidation state with simulated atmospheric aging, are investigated experimentally in flame-generated nanoparticles containing Mn, Cr, and Fe. The results demonstrate that the initial fraction of Cr(VI) within the particles decreases with increasing total metal concentration in the flame. In contrast, the initial Mn oxidation state was only partly controlled by metal loading, suggesting the importance of other factors. Two reaction pathways, one reductive and one oxidative, were found to be operating simultaneously during simulated atmospheric aging. The oxidative pathway depended upon the presence of simulated sunlight and O3, whereas the reductive pathway occurred in the presence of simulated sunlight alone. The reductive pathway appears to be rapid but transient, allowing the oxidative pathway to dominate with longer aging times, i.e. greater than ∼8 hours. The presence of Mn within the particles enhanced the importance of the oxidative pathway, leading to more net Cr oxidation during aging implying that Mn can mediate oxidation by removal of electrons from other particulate metals. PMID:20046215

  13. Redox Dynamics of Mixed Metal (Mn, Cr, and Fe) Ultrafine Particles

    SciTech Connect

    Nico, Peter S.; Kumfer, Benjamin M.; Kennedy, Ian M.; Anastasio, Cort

    2008-08-01

    The impact of particle composition on metal oxidation state, and on changes in oxidation state with simulated atmospheric aging, are investigated experimentally in flame-generated nanoparticles containing Mn, Cr, and Fe. The results demonstrate that the initial fraction of Cr(VI) within the particles decreases with increasing total metal concentration in the flame. In contrast, the initial Mn oxidation state was only partly controlled by metal loading, suggesting the importance of other factors. Two reaction pathways, one reductive and one oxidative, were found to be operating simultaneously during simulated atmospheric aging. The oxidative pathway depended upon the presence of simulated sunlight and O{sub 3}, whereas the reductive pathway occurred in the presence of simulated sunlight alone. The reductive pathway appears to be rapid but transient, allowing the oxidative pathway to dominate with longer aging times, i.e. greater than {approx}8 hours. The presence of Mn within the particles enhanced the importance of the oxidative pathway, leading to more net Cr oxidation during aging implying that Mn can mediate oxidation by removal of electrons from other particulate metals.

  14. Role of carbon in improving the shape memory effect of Fe-Mn-Si-Cr-Ni alloys by thermo-mechanical treatments

    NASA Astrophysics Data System (ADS)

    Peng, Huabei; Song, Fan; Wang, Shanling; Zhang, Chengyan; Wen, Yuhua

    2015-05-01

    To clarify the role of carbon in improving the shape memory effect of Fe-Mn-Si-based shape memory alloys by thermomechanical treatments, we investigated the effect of optimum thermomechanical treatments on shape memory effect and microstructures of Fe-14Mn-5Si-8Cr-4Ni and Fe-14Mn-5Si-8Cr-4Ni-0.12C alloys. The Cr23C6 particles in optimum thermomechanical-treated Fe-14Mn-5S-8Cr-4Ni-0.12C more effectively prevented collisions between stress-induced ɛ martensite bands than the residual α‧ martensite in optimum thermomechanical-treated Fe-14Mn-5Si-8Cr-4Ni. This result is attributed to the thinner width of stress-induced ɛ martensite bands in optimum thermomechanical-treated Fe-14Mn-5S-8Cr-4Ni-0.12C compared to optimum thermomechanical-treated Fe-14Mn-5Si-8Cr-4Ni. In addition, the Cr23C6 particles formed at more sites and provided more obstacles as compared with the residual α‧ martensite. Accordingly, the recovery strain of Fe-14Mn-5Si-8Cr-4Ni-0.12C was higher than that of Fe-14Mn-5Si-8Cr-4Ni. It is concluded that carbon addition is beneficial to further improving the shape memory effect of Fe-Mn-Si-based shape memory alloys by thermomechanical treatments.

  15. Carbides in iron-rich Fe-Mn-Cr-Mo-Al-Si-C systems

    NASA Technical Reports Server (NTRS)

    Lemkey, F. D.; Gupta, H.; Nowotny, H.; Wayne, S. F.

    1984-01-01

    The optimization of high carbon iron-base superalloy properties with duplex microstructure gamma + M7C3 carbide requires analysis in the context of a seven-component system. Data are first provided here for the Fe-Mn-Cr-Mo-C quinary system, at 30 at. pct carbon. A characterization of competing carbides, according to a pseudoternary phase diagram at 35 wt pct iron, is made from isothermal sections. It is noted that while M7C3 and M3C carbides' occurrences are respectively favored at the Cr and Mn corners, the M2C carbide and molybdenum cementite are predominant with increasing amounts of Mo. Lattice parameters are reported for the various carbides.

  16. Iron-base superalloys - A phase analysis of the multicomponent system (Fe-Mn-Cr-Mo-Nb-Al-Si-C)

    NASA Technical Reports Server (NTRS)

    Gupta, H.; Nowotny, H.; Lemkey, F. D.

    1988-01-01

    In the course of studies on the iron-rich multicomponent system Fe-Mn-Cr-Mo-Nb-Al-Si-C, work was concentrated on pertinent quinary and six-component combinations namely Fe-Mn-Al-Si-C, Fe-Cr-Al-Si-C and Fe-Mn-Cr-Al-Si-C which had been elaborated at 65, 72, and 80 wt pct Fe. Manganese acts as a strong stabilizer for the cementite carbide. Chromium seems to stabilize the iron aluminide Fe2Al5 which forms in a considerable amount within an alloy of nominal composition Fe(65)Mn(15)Cr(12)Al(5)Si(2)C(1) (percent by weight). Although the Mn3AlC carbide is, like Fe3AlC, a perovskite carbide, manganese does not appear to favor the formation of the perovskite carbide. Because of the relatively low sintering temperature (700 C), for al large portion of the samples equilibria conditions are not always reached.

  17. Initial magnetic susceptibility of Sn films with Cr, Mn, Fe, Co and Ni

    NASA Astrophysics Data System (ADS)

    Henger, U.; Korn, D.

    1986-04-01

    Sn alloys with additions of 3d elements are artificially produced by vapour quenching on a liquid helium cooled substrate. The magnetic susceptibility of the as produced films is measured in situ by a sensitive ac magnetic induction method. The experimental result demonstrates that all mentioned 3d atoms have no localized magnetic moment in Sn except crystalline SnMn ( S = {4}/{2}), amorphous SnMn ( S = {3}/{2}) and crystalline SnCr ( S = 1). SnFe and SnCo become magnetic at the percolation limit of 25 at % of the 3d element, SnNi does not. The Sn systems with localized magnetic moment show spinglass behaviour.

  18. Neutron diffraction analysis of Nd3Fe29 - xTx (T=Ti, Cr, Mn)

    NASA Astrophysics Data System (ADS)

    Yelon, W. B.; Hu, Z.

    1996-02-01

    Rietveld analysis of neutron-diffraction data from Nd3Fe29-xTx (T=Ti, Cr, and Mn) has been used to determine the location of the substitutional atoms and the magnetic moments. Reanalysis of the T=Ti data confirms that the space group A2/m is a better choice than P21/c, which had previously been used to describe the structure. The Ti atom locations and concentrations remain unaffected in the two space groups, but for the other substituents the refined concentrations are well behaved in A2/m, whereas in P21/c the refinements were unstable due to the symmetry relations between certain substituted sites. The site occupancies are analyzed in terms of steric and environment effects. A possible explanation for the high Curie temperature of the Cr compound is proposed.

  19. Investigation of the mechanical properties of FeNiCrMnSi high entropy alloy wear resistant

    NASA Astrophysics Data System (ADS)

    Buluc, G.; Florea, I.; Chelariu, R.; Popescu, G.; Carcea, I.

    2016-06-01

    In this paper we investigated microstructure, hardness and wear resistance for FeNiCrMnAl, high entropy alloy. The FeNiCrMnSi, high entropy alloy was elaborated in a medium induction furnace, by choosing the silicon, as an alliance element within the equi- atomic high entropy alloy, we managed to obtain a dendritic structure, the formation of intermetallic compounds or separated silicon. The medium hardness value of the investigated alloy was 948.33 HV and the medium value of the friction coefficient was 0.6655 in the first 20 seconds and 0.5425 for 1667 seconds. The volume loss of the high entropy alloy FeNiCrMnSi was 0.0557 mm3.

  20. Galvanomagnetic properties of Fe{sub 2}YZ (Y = Ti, V, Cr, Mn, Fe, Ni; Z = Al, Si) heusler alloys

    SciTech Connect

    Kourov, N. I. Marchenkov, V. V.; Belozerova, K. A.; Weber, H. W.

    2015-11-15

    The Hall effect and the magnetoresistance of Fe{sub 2}YZ Heusler alloys, where Y = Ti, V, Cr, Mn, Fe, and Ni, are the 3d transition metals and Z = Al and Si are the s, p elements of the third period of the periodic table, are studied at T = 4.2 K in magnetic fields H ≤ 100 kOe. It is shown that, in the high-field limit (H > 10 kOe), the value and the sign of the normal (R{sub 0}) and anomalous (R{sub s}) Hall coefficients change anomalously during transition from paramagnetic (Y = Ti, V) to ferromagnetic (Y = Cr, Mn, Fe, Ni) alloys. These coefficients have different signs for all alloys. Constant R{sub s} in the ferromagnetic alloys is positive, proportional to the residual resistivity ratio (R{sub s} ∝ ρ{sub 0}{sup 3.1}), and inversely proportional to spontaneous magnetization. The magnetoresistance of the alloys is a few percent and has a negative sign. A positive addition to transverse magnetoresistance is only detected in high magnetic fields, H > 10 kOe.

  1. Galvanomagnetic properties of Fe2YZ (Y = Ti, V, Cr, Mn, Fe, Ni; Z = Al, Si) heusler alloys

    NASA Astrophysics Data System (ADS)

    Kourov, N. I.; Marchenkov, V. V.; Belozerova, K. A.; Weber, H. W.

    2015-11-01

    The Hall effect and the magnetoresistance of Fe2YZ Heusler alloys, where Y = Ti, V, Cr, Mn, Fe, and Ni, are the 3 d transition metals and Z = Al and Si are the s, p elements of the third period of the periodic table, are studied at T = 4.2 K in magnetic fields H ≤ 100 kOe. It is shown that, in the high-field limit ( H > 10 kOe), the value and the sign of the normal ( R 0) and anomalous ( R s ) Hall coefficients change anomalously during transition from paramagnetic (Y = Ti, V) to ferromagnetic (Y = Cr, Mn, Fe, Ni) alloys. These coefficients have different signs for all alloys. Constant R s in the ferromagnetic alloys is positive, proportional to the residual resistivity ratio ( R s ∝ ρ 0 3.1 ), and inversely proportional to spontaneous magnetization. The magnetoresistance of the alloys is a few percent and has a negative sign. A positive addition to transverse magnetoresistance is only detected in high magnetic fields, H > 10 kOe.

  2. Weldability of a high entropy CrMnFeCoNi alloy

    DOE PAGESBeta

    Wu, Zhenggang; David, Stan A.; Feng, Zhili; Bei, Hongbin

    2016-07-19

    We present the high-entropy alloys are unique alloys in which five or more elements are all in high concentrations. In order to determine its potential as a structural alloy, a model face-centered-cubic CrMnFeCoNi alloy was selected to investigate its weldability. Welds produced by electron beam welding show no cracking. The grain structures within the fusion zone (FZ) are controlled by the solidification behavior of the weld pool. The weldment possesses mechanical properties comparable to those of the base metal (BM) at both room and cryogenic temperatures. Finally, compared with the BM, deformation twinning was more pronounced in the FZ ofmore » the tested alloy.« less

  3. Ti(3+)-, V(2+/3+)-, Cr(2+/3+)-, Mn(2+)-, and Fe(2+)-substituted MOF-5 and redox reactivity in Cr- and Fe-MOF-5.

    PubMed

    Brozek, Carl K; Dincă, Mircea

    2013-08-28

    The metal nodes in metal-organic frameworks (MOFs) are known to act as Lewis acid catalysts, but few reports have explored their ability to mediate reactions that require electron transfer. The unique chemical environments at the nodes should facilitate unusual redox chemistry, but the difficulty in synthesizing MOFs with metal ions in reduced oxidation states has precluded such studies. Herein, we demonstrate that MZn3O(O2C-)6 clusters from Zn4O(1,4-benzenedicarboxylate)3 (MOF-5) serve as hosts for V(2+) and Ti(3+) ions and enable the synthesis of the first MOFs containing these reduced early metal ions, which can be accessed from MOF-5 by postsynthetic ion metathesis (PSIM). Additional MOF-5 analogues featuring Cr(2+), Cr(3+), Mn(2+), and Fe(2+) at the metal nodes can be obtained by similar postsynthetic methods and are reported here for the first time. The inserted metal ions are coordinated within an unusual all-oxygen trigonal ligand field and are accessible to both inner- and outer-sphere oxidants: Cr(2+)- converts into Cr(3+)-substituted MOF-5, while Fe(2+)-MOF-5 activates NO to produce an unusual Fe-nitrosyl complex.

  4. Effects of C and Cr content on high-temperature microstructures of Fe-9Al-30Mn-xC-yCr alloys

    SciTech Connect

    Chen, May-Show; Cheng, Hsin-Chung; Huang, Chiung-Fang; Chao, Chih-Yeh; Ou, Keng-Liang; Yu, Chih-Hua

    2010-02-15

    This investigation elucidated the effects of C and Cr content on the high-temperature microstructures of Fe-9Al-30Mn-xC-yCr alloys by means of optical microscopy and transmission electron microscopy. With increasing Cr content, the phase transition sequence within the {alpha} phase was found to be {alpha} + B2 {yields} {alpha} + B2 + DO{sub 3} {yields} {alpha} + DO{sub 3}. And with increasing C content, a {gamma} {yields} ({gamma} + {kappa}) phase transition was observed within the {gamma} phase. The {kappa} phase carbides ((Fe,Mn){sub 3}AlC{sub x}) had an ordered L'1{sub 2}-type structure with lattice parameter a = 0.368 nm and were formed by a spinodal decomposition during quenching. The amounts of Cr{sub 7}C{sub 3} increased with the C and Cr content. Moreover, the Al and Mn content played important roles in expanding the ({alpha} + {gamma}) region. These features have not been previously reported in the Fe-Al-Mn-C-Cr alloy system.

  5. Microstructures and mechanical properties of compositionally complex Co-free FeNiMnCr18 FCC solid solution alloy

    DOE PAGESBeta

    Wu, Z.; Bei, H.

    2015-07-01

    Recently, a structurally-simple but compositionally-complex FeNiCoMnCr high entropy alloy was found to have excellent mechanical properties (e.g., high strength and ductility). To understand the potential of using high entropy alloys as structural materials for advanced nuclear reactor and power plants, it is necessary to have a thorough understanding of their structural stability and mechanical properties degradation under neutron irradiation. Furthermore, this requires us to develop a similar model alloy without Co because material with Co will make post-neutron-irradiation testing difficult due to the production of the 60Co radioisotope. In order to achieve this goal, a FCC-structured single-phase alloy with amore » composition of FeNiMnCr18 was successfully developed. This near-equiatomic FeNiMnCr18 alloy has good malleability and its microstructure can be controlled by thermomechanical processing. By rolling and annealing, the as-cast elongated-grained-microstructure is replaced by homogeneous equiaxed grains. The mechanical properties (e.g., strength and ductility) of the FeNiMnCr18 alloy are comparable to those of the equiatomic FeNiCoMnCr high entropy alloy. Both strength and ductility increase with decreasing deformation temperature, with the largest difference occurring between 293 and 77 K. Extensive twin-bands which are bundles of numerous individual twins are observed when it is tensile-fractured at 77 K. No twin bands are detected by EBSD for materials deformed at 293 K and higher. Ultimately the unusual temperature-dependencies of UTS and uniform elongation could be caused by the development of the dense twin substructure, twin-dislocation interactions and the interactions between primary and secondary twinning systems which result in a microstructure refinement and hence cause enhanced strain hardening and postponed necking.« less

  6. Oxidation behavior of Mn and Mo alloyed Fe-16Ni-(5-8)Cr-3. 2Si-1. 0Al

    SciTech Connect

    Rawers, J.C.; Oh, J.M.; Dunning, J. )

    1990-02-01

    Oxidation tests were conducted on a master alloy, Fe-16Ni-(5-8)Cr-3Si-1Al, to which (0-4) wt/o pct Mn and/or Mo were added. Tests were conducted at temperatures ranging from 1,073-1,273 K for times up to 1,000 hr. Additions of Mn resulted in formation of a dual oxide structure and decreased oxidation protection. Addition of Mo significantly improved oxidation protection by formation of an intermetallic Fe(Mo)Si precipitate that eventually formed a protective SiO{sub 2} oxide sublayer. The oxidation protection was related to the alloy components and concentration.

  7. The effect of substitution of Mn by Fe and Cr on the martensitic transition in the Ni50Mn34In16 alloy.

    PubMed

    Sharma, V K; Chattopadhyay, M K; Nath, S K; Sokhey, K J S; Kumar, R; Tiwari, P; Roy, S B

    2010-12-01

    The potential shape memory alloy Ni(50)Mn(34)In(16) is studied with partial substitution of Mn with Fe and Cr to investigate the effect of such substitution on the martensitic transition in the Ni-Mn-In alloy system. The results of ac susceptibility, magnetization and electrical resistivity measurements show that while the substitution with Cr increases the martensitic transition temperature, the substitution with Fe decreases it. Possible reasons for this shift in martensitic transition are discussed. Evidence of kinetic arrest of the austenite to martensite phase transition in the Fe substituted alloys is also presented. Unlike the kinetic arrest of the austenite to martensite phase transition in the parent Ni(50)Mn(34)In(16) alloy which takes place in the presence of high external magnetic field, the kinetic arrest of the austenite to martensite phase transition in the Fe doped alloy occurs even in zero magnetic field. The Cr substituted alloys, on the other hand, show no signature of kinetic arrest of this phase transition.

  8. Magnetic susceptibility of SnCr, SnMn, SnFe, SnCo and SnNi

    NASA Astrophysics Data System (ADS)

    Henger, U.; Korn, D.

    1984-11-01

    The initial ac susceptibility χ of vapour condensed Sn films with 3d transition metals is measured in situ. SnMn is a spin glass at concentrations up to 36 at% Mn. Spin glass behaviour in SnCr is only observed after annealing to temperatures between 220 and 300 K. This can be related to crystallization in the amorphous and disordered SnCr. SnFe and SnCo exhibit either temperature independent χ or χ below experimental detection. Above the percolation limit χ is getting large and temperature dependent. That is valid for Sn with 30 at% Fe or Co. In Sn films with 50 at% Ni the susceptibility is below the experimental limit.

  9. The effects of Ni, Mo, Ti and Si on the mechanical properties of Cr free Mn steel (Fe-25Mn-5Al-2C)

    NASA Technical Reports Server (NTRS)

    Schuon, S. R.

    1982-01-01

    The FeMnAlC alloys may hold potential as Cr-free replacements for high strategic material iron base superalloys, but little is known about their intermediate temperature (650 C to 870 C) mechanical properties. The effects of alloying elements on the mechanical properties of model FeMnAlC alloys were studied. Results showed that modified FeMnAlC alloys had promising short term, intermediate temperature properties but had relatively poor stress rupture lives at 172 MPa and 788 C. Room temperature and 788 C tensile strength of FeMnAlC alloys were better than common cast stainless steels. Changes in room temperature tensile and 788 C tensile strength and ductility, and 788 C stress rupture life were correlated with changes in Ni, Mo, Ti, and Si levels due to alloying effects on interstitial carbon levels and carbide morphology. Fe-25Mn-5Al-2C had a very poor stress rupture life at 172 MPa and 788 C. Addition of carbide-forming elements improved the stress rupture life.

  10. Low-temperature heat capacity upon the transition from paramagnetic to ferromagnetic Heusler alloys Fe2 MeAl ( Me = Ti, V, Cr, Mn, Fe, Co, Ni)

    NASA Astrophysics Data System (ADS)

    Kourov, N. I.; Marchenkov, V. V.; Korolev, A. V.; Lukoyanov, A. V.

    2016-07-01

    The heat capacity of band magnets Fe2 MeAl ( Me = Ti, V, Cr, Mn, Fe, Co, Ni) ordered in crystal structure L21 has been measured in the range 2 K ≤ T ≤ 50 K. The dependences of the Debye temperature ΘD, the Sommerfeld coefficient γ, and the temperature-independent contribution to heat capacity C 0 on the number of valence electrons z in the alloys have been determined.

  11. High-field magnetization of heusler alloys Fe2 XY ( X = Ti, V, Cr, Mn, Fe, Co, Ni; Y = Al, Si)

    NASA Astrophysics Data System (ADS)

    Kourov, N. I.; Marchenkov, V. V.; Korolev, A. V.; Belozerova, K. A.; Weber, H. W.

    2015-10-01

    The magnetization curves of ferromagnetic Heusler alloys Fe2 XY (where X = Ti, V, Cr, Mn, Fe, Co, Ni are transition 3 d elements and Y = Al, Si are the s and p elements of the third period of the Periodic Table) have been measured at T = 4.2 K in the field range H ≤ 70 kOe. It has been shown that the high-field ( H ≥ 20 kOe) magnetization is described within the Stoner model.

  12. Magnetism of hexagonal Mn{sub 1.5}X{sub 0.5}Sn (X = Cr, Mn, Fe, Co) nanomaterials

    SciTech Connect

    Fuglsby, R.; Kharel, P.; Zhang, W.; Sellmyer, D. J.; Valloppilly, S.; Huh, Y.

    2015-05-07

    Mn{sub 1.5}X{sub 0.5}Sn (X = Cr, Mn, Fe, Co) nanomaterials in the hexagonal Ni{sub 2}In-type crystal structure have been prepared using arc-melting and melt spinning. All the rapidly quenched Mn{sub 1.5}X{sub 0.5}Sn alloys show moderate saturation magnetizations with the highest value of 458 emu/cm{sup 3} for Mn{sub 1.5}Fe{sub 0.5}Sn, but their Curie temperatures are less than 300 K. All samples except the Cr containing one show spin-glass-like behavior at low temperature. The magnetic anisotropy constants calculated from the high-field magnetization curves at 100 K are on the order of 1 Merg/cm{sup 3}. The vacuum annealing of the ribbons at 550 °C significantly improved their magnetic properties with the Curie temperature increasing from 206 K to 273 K for Mn{sub 1.5}Fe{sub 0.5}Sn.

  13. Effects of cold rolling on the microstructure and mechanical properties of Fe-Ni-Mn-Mo-Ti-Cr maraging steels

    NASA Astrophysics Data System (ADS)

    Mahmudi, Abbas; Nedjad, Syamak Hossein; Behnam, Mir Masud Jabbari

    2011-10-01

    Effects of cold rolling on the microstructure and mechanical properties of Fe-Ni-Mn-Mo-Ti-Cr maraging steels were studied. To investigate the microstructure and mechanical properties, optical microscopy, scanning electron microscopy, X-ray diffraction, tensile test, and hardness test were used. The results show that the solution-annealing treatment in the cold-rolled steel redounds to the formation of submicrocrystalline Fe2(Mo, Ti) Laves phase particles, which are stable at high temperatures. These secondary Laves phase particles prevent from recrystallization at high temperatures and correspond to semi-brittle fracture in the subsequent aging treatment.

  14. The use of diffusion multiples to explore the Co-Cr-Fe-Mn-Ni high entropy system

    NASA Astrophysics Data System (ADS)

    Wilson, Paul Nathaniel

    High entropy alloys (HEAs) or Multi-principal element alloys (MEAs) are a relatively new class of alloys. These alloys are defined as having at least five major alloying elements in atomic percent from 5% to 35%. There are hundreds of thousands of equiatomic compositions possible and only a fraction have been explored. This project examines diffusion multiples as a method to accelerate alloy development in these systems. The system chosen for this experiment is the Co-Cr-Fe-Mn-Ni system. The methodology developed for creating these diffusion multiples involved a two-step process. In the first step two binary alloys (50at-% Fe-Mn and 50 at%- Ni-Co ) were diffusion bonded together. In the second step, under uniaxial compression, was used to bond Cr to diffusion couple prepared in Step I. Successful diffusion multiples were created by this method. An auxiliary method named differential melting liquid impingement (DMLI) was developed that created diffusion multiples using liquid processing methods that will be described. After creation of these multiples, the ternary and quinary interface regions were examined using scanning electron microscopy (SEM), transmission electron microscopy (TEM), energy dispersive spectroscopy (EDS), and nanoindentation. The Cr/NiCo region experienced interdiffusion but no intermediate phase formation retaining the FCC / BCC interface at the hot-pressing temperature (1200 °C). However, upon cooling from 1200 °C, the BCC region adjacent to the interface decomposed into BCC + sigma. In contrast, the Cr/FeMn interface region developed a layered structure of FCC/sigma/BCC suggesting that sigma is stable at 1200 °C in contradiction to the published 1200 °C ternary phase diagram. Upon cooling, the sigma present at 1200 °C decomposed into FCC + sigma, except in samples that were contaminated with C; in those cases, FCC + M23C6 was observed as the decomposition product. The quinary regions were evaluated using the various HEA parameters, namely

  15. Corrosion Behavior of High Nitrogen Nickel-Free Fe-16Cr-Mn-Mo-N Stainless Steels

    NASA Astrophysics Data System (ADS)

    Chao, K. L.; Liao, H. Y.; Shyue, J. J.; Lian, S. S.

    2014-04-01

    The purpose of the current study is to develop austenitic nickel-free stainless steels with lower chromium content and higher manganese and nitrogen contents. In order to prevent nickel-induced skin allergy, cobalt, manganese, and nitrogen were used to substitute nickel in the designed steel. Our results demonstrated that manganese content greater than 14 wt pct results in a structure that is in full austenite phase. The manganese content appears to increase the solubility of nitrogen; however, a lower corrosion potential was found in steel with high manganese content. Molybdenum appears to be able to increase the pitting potential. The effects of Cr, Mn, Mo, and N on corrosion behavior of Fe-16Cr-2Co-Mn-Mo-N high nitrogen stainless steels were evaluated with potentiodynamic tests and XPS surface analysis. The results reveal that anodic current and pits formation of the Fe-16Cr-2Co-Mn-Mo-N high nitrogen stainless steels were smaller than those of lower manganese and nitrogen content stainless steel.

  16. Study of the effect of annealing on defects in Fe Mn Si Cr Ni C alloy by slow positron beam

    NASA Astrophysics Data System (ADS)

    Mostafa, Khaled. M.; De Baerdemaeker, J.; Van Caenegem, N.; Segers, D.; Houbaert, Y.

    2008-10-01

    FeMnSi shape memory alloys (SMAs) have received much attention as one-way SMAs due to their cost-effectiveness. Variable-energy (0-30 keV) positron beam studies have been carried out on a Fe-Mn-Si-Cr-Ni-C alloy with different degrees of deformation. Doppler broadening profiles of the positron annihilation as a function of incident positron energy were shown to be quite sensitive to defects introduced by deformation. The variation of the nature and the concentration of defects are studied as a function of isochronal annealing temperature. These results are correlated with the data measured with the positron annihilation lifetime spectroscopy (PALS). The positron annihilation results are compared to XRD and optical microscopy (OM).

  17. Corrosion behavior and mechanical properties of a new nitrogen strengthened Fe-Mn-Cr alloy

    SciTech Connect

    Brill, U.; Agarwal, D.C.

    1999-07-01

    Nitrogen alloyed, Ni-free, austenitic stainless steels with more than 1 wt.% nitrogen are a new group of alloys with promising properties. They exhibit a very interesting combination of high strength and toughness with a high corrosion resistance in various environments. This work shows the influence of chromium, molybdenum and nitrogen on the corrosion resistance of Fe25Mn-alloys. According to these results Fe25Mn-alloys with approximately 20 wt.% chromium about 3 wt.% molybdenum and approximately 1.3 wt.% nitrogen have an excellent corrosion resistance. The critical pitting temperature (CPT) of 61 C and the critical crevice temperature (CCT) of 37 C when tested according to ASTM G-48 A were significantly higher than the well established AISI 316 L stainless steel.

  18. Sediment fractionation of Cu, Ni, Zn, Cr, Mn, and Fe in one experimental and three natural marshes

    SciTech Connect

    Lindau, C.W.; Hossner, L.R.

    1982-07-01

    Dredged sediments from the Gulf Intracoastal Waterway near Galveston, Tex., were used as a substrate material in the construction of an experimental intertidal salt marsh. Selected substrate properties were compared with those of established marshes. Clay mineralogical properties of the experimental marsh were compared with those of three nearby natural marshes. A sequential chemical extraction procedure was used to obtain data on the partitioning of micronutrients and heavy metals among selected marsh substrate fractions. Clay minerals found in the sediments of the experimental marsh were equivalent to those identified in the natural marshes. Total elemental substrate concentrations of Cu, Ni, Cr, Zn, Mn, and Fe averaged 7.9, 8.6, 25.5, 25.2, 123, and 12,200 ..mu..g/g, respectively, over the four marsh sites. Copper, nickel, zinc, and chromium displayed only minor variations in substrate partitioning between the experimental and natural marsh samples. Micronutrients and heavy metal concentrations in the exchangeable and water-soluble fraction were low compared with other fractions. Approximately 30% of the total substrate Cu, Ni, and Zn was associated with the organic matter fraction. Metals fixed within the lattice structures of clay and silicate minerals ranged from 20% Mn for experimental marsh samples to 90% Cr for one of the natural marshes. Major differences in Mn and Fe substrate partitioning were observed when the experimental marsh samples were compared with those of the natural marshes.

  19. Precipitation sensitivity to alloy composition in Fe-Cr-Mn austenitic steels developed for reduced activation for fusion application

    SciTech Connect

    Maziasz, P.J.; Klueh, R.L.

    1988-01-01

    Special austenitic steels are being designed in which alloying elements like Mo, Nb, and Ni are replaced with Mn, W, V, Ti, and/or Ta to reduce the long-term radioactivity induced by fusion reactor irradiation. However, the new steels still need to have properties otherwise similar to commercial steels like type 316. Precipitation strongly affects strength and radiation-resistance in austenitic steels during irradiation at 400--600/degree/C, and precipitation is also usually quite sensitive to alloy composition. The initial stage of development was to define a base Fe-Cr-Mn-C composition that formed stable austenite after annealing and cold-working, and resisted recovery or excessive formation of coarse carbide and intermetallic phases during elevated temperature annealing. These studies produced a Fe-12Cr-20Mn-0.25C base alloy. The next stage was to add the minor alloying elements W, Ti, V, P, and B for more strength and radiation-resistance. One of the goals was to produce fine MC precipitation behavior similar to the Ti-modified Fe-Cr-Ni prime candidate alloy (PCA). Additions of Ti+V+P+B produced fine MC precipitation along network dislocations and recovery/recrystallization resistance in 20% cold worked material aged at 800/degree/C for 166h, whereas W, Ti, W+Ti, or Ti+P+B additions did not. Addition of W+Ti+V+P+B also produced fine MC, but caused some sigma phase formation and more recrystallization as well. 29 refs., 14 figs., 9 tabs.

  20. Electronic structure, magnetism, and antisite disorder in CoFeCrGe and CoMnCrAl quaternary Heusler alloys

    DOE PAGESBeta

    Enamullah, .; Venkateswara, Y.; Gupta, Sachin; Varma, Manoj Raama; Singh, Prashant; Suresh, K. G.; Alam, Aftab

    2015-12-10

    In this study, we present a combined theoretical and experimental study of two quaternary Heusler alloys CoFeCrGe (CFCG) and CoMnCrAl (CMCA), promising candidates for spintronics applications. Magnetization measurement shows the saturation magnetization and transition temperature to be 3 μB, 866 K and 0.9 μB, 358 K for CFCG and CMCA respectively. The magnetization values agree fairly well with our theoretical results and also obey the Slater-Pauling rule, a prerequisite for half metallicity. A striking difference between the two systems is their structure; CFCG crystallizes in fully ordered Y-type structure while CMCA has L21 disordered structure. The antisite disorder adds amore » somewhat unique property to the second compound, which arises due to the probabilistic mutual exchange of Al positions with Cr/Mn and such an effect is possibly expected due to comparable electronegativities of Al and Cr/Mn. Ab initio simulation predicted a unique transition from half metallic ferromagnet to metallic antiferromagnet beyond a critical excess concentration of Al in the alloy.« less

  1. Electronic structure, magnetism, and antisite disorder in CoFeCrGe and CoMnCrAl quaternary Heusler alloys

    SciTech Connect

    Enamullah, .; Venkateswara, Y.; Gupta, Sachin; Varma, Manoj Raama; Singh, Prashant; Suresh, K. G.; Alam, Aftab

    2015-12-10

    In this study, we present a combined theoretical and experimental study of two quaternary Heusler alloys CoFeCrGe (CFCG) and CoMnCrAl (CMCA), promising candidates for spintronics applications. Magnetization measurement shows the saturation magnetization and transition temperature to be 3 μB, 866 K and 0.9 μB, 358 K for CFCG and CMCA respectively. The magnetization values agree fairly well with our theoretical results and also obey the Slater-Pauling rule, a prerequisite for half metallicity. A striking difference between the two systems is their structure; CFCG crystallizes in fully ordered Y-type structure while CMCA has L21 disordered structure. The antisite disorder adds a somewhat unique property to the second compound, which arises due to the probabilistic mutual exchange of Al positions with Cr/Mn and such an effect is possibly expected due to comparable electronegativities of Al and Cr/Mn. Ab initio simulation predicted a unique transition from half metallic ferromagnet to metallic antiferromagnet beyond a critical excess concentration of Al in the alloy.

  2. Specific features of the electrical resistivity of half-metallic ferromagnets Fe2MeAl (Me = Ti, V, Cr, Mn, Fe, Ni)

    NASA Astrophysics Data System (ADS)

    Kourov, N. I.; Marchenkov, V. V.; Belozerova, K. A.; Weber, H. W.

    2014-03-01

    The transport properties of half-metallic ferromagnetic Heusler alloys Fe2MeAl (where Me = Ti, V, Cr, Mn, Fe, and Ni are 3 d transition elements) have been measured in the temperature range of 4-900 K. The specific features in the behavior of the electrical resistivity have been considered in terms of the two-current conduction model, which takes into account the presence of an energy gap in the electron spectrum of the alloys near the Fermi level.

  3. Nano-twin Mediated Plasticity in Carbon-containing FeNiCoCrMn High Entropy Alloys

    SciTech Connect

    Wu, Zhenggang; Bei, Hongbin; Parish, Chad M

    2015-06-14

    Equiatomic FeNiCoCrMn alloy has been reported to exhibit promising strength and ductility at cryogenic temperature and deformation mediated by nano-twining appeared to be one of the main reasons. We use the FeNiCoCrMn alloy as a base alloy to seek further improvement of its mechanical properties by alloying additional elements, i.e., interstitial carbon. Moreover, the effects of carbon on microstructures, mechanical properties and twinning activities were investigated in two different temperatures (77 and 293 K). With addition of 0.5 at% C, the high entropy alloy still remains entirely single phase face-centered cubic (FCC) crystal structure. We found that these materials can be cold rolled and recrystallized to produce a microstructure with equiaxed grains. Both strain hardening rate and strength are enhanced while high uniform elongations to fracture (~70% at 77 K and ~40% at 293 K) are still maintained. The increased strain hardening and strength could be caused by the promptness of deformation twinning in C-containing high entropy alloys.

  4. Nano-twin Mediated Plasticity in Carbon-containing FeNiCoCrMn High Entropy Alloys

    DOE PAGESBeta

    Wu, Zhenggang; Bei, Hongbin; Parish, Chad M

    2015-06-14

    Equiatomic FeNiCoCrMn alloy has been reported to exhibit promising strength and ductility at cryogenic temperature and deformation mediated by nano-twining appeared to be one of the main reasons. We use the FeNiCoCrMn alloy as a base alloy to seek further improvement of its mechanical properties by alloying additional elements, i.e., interstitial carbon. Moreover, the effects of carbon on microstructures, mechanical properties and twinning activities were investigated in two different temperatures (77 and 293 K). With addition of 0.5 at% C, the high entropy alloy still remains entirely single phase face-centered cubic (FCC) crystal structure. We found that these materials canmore » be cold rolled and recrystallized to produce a microstructure with equiaxed grains. Both strain hardening rate and strength are enhanced while high uniform elongations to fracture (~70% at 77 K and ~40% at 293 K) are still maintained. The increased strain hardening and strength could be caused by the promptness of deformation twinning in C-containing high entropy alloys.« less

  5. Effect of one-step recrystallization on the grain boundary evolution of CoCrFeMnNi high entropy alloy and its subsystems.

    PubMed

    Chen, Bo-Ru; Yeh, An-Chou; Yeh, Jien-Wei

    2016-01-01

    In this study, the grain boundary evolution of equiatomic CoCrFeMnNi, CoCrFeNi, and FeCoNi alloys after one-step recrystallization were investigated. The special boundary fraction and twin density of these alloys were evaluated by electron backscatter diffraction analysis. Among the three alloys tested, FeCoNi exhibited the highest special boundary fraction and twin density after one-step recrystallization. The special boundary increment after one-step recrystallization was mainly affected by grain boundary velocity, while twin density was mainly affected by average grain boundary energy and twin boundary energy.

  6. Effect of one-step recrystallization on the grain boundary evolution of CoCrFeMnNi high entropy alloy and its subsystems

    PubMed Central

    Chen, Bo-Ru; Yeh, An-Chou; Yeh, Jien-Wei

    2016-01-01

    In this study, the grain boundary evolution of equiatomic CoCrFeMnNi, CoCrFeNi, and FeCoNi alloys after one-step recrystallization were investigated. The special boundary fraction and twin density of these alloys were evaluated by electron backscatter diffraction analysis. Among the three alloys tested, FeCoNi exhibited the highest special boundary fraction and twin density after one-step recrystallization. The special boundary increment after one-step recrystallization was mainly affected by grain boundary velocity, while twin density was mainly affected by average grain boundary energy and twin boundary energy. PMID:26923713

  7. Mn-Cr dating of Fe- and Ca-rich olivine from 'quenched' and 'plutonic' angrite meteorites using Secondary Ion Mass Spectrometry

    NASA Astrophysics Data System (ADS)

    McKibbin, Seann J.; Ireland, Trevor R.; Amelin, Yuri; Holden, Peter

    2015-05-01

    Angrite meteorites are suitable for Mn-Cr relative dating (53Mn decays to 53Cr with a half life of 3.7 Myr) using Secondary Ion Mass Spectrometry (SIMS) because they contain olivine and kirschsteinite with very high 55Mn/52Cr ratios arising from very low Cr concentrations. Discrepant Mn-Cr and U-Pb time intervals between the extrusive or 'quenched' angrite D'Orbigny and some slowly cooled or 'plutonic' angrites suggests that some have been affected by secondary disturbances, but this seems to have occurred in quenched rather than in slow-cooled plutonic angrites, where such disturbance or delay of isotopic closure might be expected. Using SIMS, we investigate the Mn-Cr systematics of quenched angrites to higher precision than previously achieved by this method and extend our investigation to non-quenched (plutonic or sub-volcanic) angrites. High values of 3.54 (±0.18) × 10-6 and 3.40 (±0.19) × 10-6 (2-sigma) are found for the initial 53Mn/55Mn of the quenched angrites D'Orbigny and Sahara 99555, which are preserved by Cr-poor olivine and kirschsteinite. The previously reported initial 53Mn/55Mn value of D'Orbigny obtained from bulk-rock and mineral separates is slightly lower and was probably controlled by Cr-rich olivine. Results can be interpreted in terms of the diffusivity of Cr in this mineral. Very low Cr concentrations in Ca-rich olivine and kirschsteinite are probably charge balanced by Al; this substitutes for Si and likely diffuses at a very slow rate because Si is the slowest-diffusing cation in olivine. Diffusion in Cr-rich Mg-Fe olivine is probably controlled by cation vacancies because of deficiency in charge-balancing Al and is therefore more prone to disturbance. The higher initial 53Mn/55Mn found by SIMS for extrusive angrites is more likely to reflect closure of Cr in kirschsteinite at the time of crystallisation, simultaneous with closure of U-Pb and Hf-W isotope systematics for these meteorites obtained from pyroxenes. For the younger

  8. Characterization of the surface of Fe-19Mn-18Cr-C-N during heat treatment in a high vacuum - An XPS study

    SciTech Connect

    Zumsande, K.; Weddeling, A.; Hryha, E.; Huth, S.; Nyborg, L.; Weber, S.; Krasokha, N.; Theisen, W.

    2012-09-15

    Nitrogen-containing CrMn austenitic stainless steels offer evident benefits compared to CrNi-based grades. The production of high-quality parts by means of powder metallurgy could be an appropriate alternative to the standard molding process leading to improved properties. The powder metallurgical production of CrMn austenitic steel is challenging on account of the high oxygen affinity of Mn and Cr. Oxides hinder the densification processes and may lower the performance of the sintered part if they remain in the steel after sintering. Thus, in evaluating the sinterability of the steel Fe-19Mn-18Cr-C-N, characterization of the surface is of great interest. In this study, comprehensive investigations by means of X-ray photoelectron spectroscopy and scanning electron microscopy combined with energy dispersive X-ray spectroscopy were performed to characterize the surface during heat treatment in a high vacuum. The results show a shift of oxidation up to 600 Degree-Sign C, meaning transfer of oxygen from the iron oxide layer to Mn-based particulate oxides, followed by progressive reduction and transformation of the Mn oxides into stable Si-containing oxides at elevated temperatures. Mass loss caused by Mn evaporation was observed accompanied by Mn oxide decomposition starting at 700 Degree-Sign C. - Highlights: Black-Right-Pointing-Pointer Surface characterization by means of XPS, SEM, and EDX analyses. Black-Right-Pointing-Pointer Heat treatment of a high CrMn powder. Black-Right-Pointing-Pointer Transfer of oxygen from the iron oxide layer to manganese-based particulate oxides. Black-Right-Pointing-Pointer Progressive reduction of Mn oxides. Black-Right-Pointing-Pointer Transformation of the Mn oxides into stable Si-containing oxides.

  9. Weathering and precipitation after meteorite impact of Ni, Cr, Fe, Ca and Mn in K-T boundary clays from Stevns Klint

    NASA Astrophysics Data System (ADS)

    Miyano, Yumiko; Yoshiasa, Akira; Tobase, Tsubasa; Isobe, Hiroshi; Hongu, Hidetomo; Okube, Maki; Nakatsuka, Akihiko; Sugiyama, Kazumasa

    2016-05-01

    Ni, Cr, Fe, Ca and Mn K-edge XANES and EXAFS spectra were measured on K-T boundary clays from Stevns Klint in Denmark. According to XANES spectra and EXAFS analyses, the local structures of Ni, Cr and Fe in K-T boundary clays is similar to Ni(OH)2, Cr2O3 and FeOOH, respectively. It is assumed that the Ni, Cr and Fe elements in impact related glasses is changing into stable hydrate and oxide by the weathering and diagenesis at the surface of the Earth. Ca in K-T boundary clays maintains the diopside-like structure. Local structure of Ca in K-T clays seems to keep information on the condition at meteorite impact. Mn has a local structure like MnCO3 with divalent state. It is assumed that the origin on low abundant of Mn in the Fe-group element in K-T clays was the consumption by life activity and the diffusion to other parts.

  10. Magnetism, structures and stabilities of cluster assembled TM@Si nanotubes (TM = Cr, Mn and Fe): a density functional study.

    PubMed

    Dhaka, Kapil; Bandyopadhyay, Debashis

    2016-08-01

    The present study reports transition metal (TM = Cr, Mn and Fe) doped silicon nanotubes with tunable band structures and magnetic properties by careful selection of cluster assemblies as building blocks using the first-principles density functional theory. We found that the transition metal doping and in addition, the hydrogen termination process can stabilize the pure silicon nanoclusters or cluster assemblies and then it could be extended as magnetic nanotubes with finite magnetic moments. Study of the band structures and density of states (DOS) of different empty and TM doped nanotubes (Type 1 to Type 4) show that these nanotubes are useful as metals, semiconductors, semi-metals and half-metals. These designer magnetic materials could be useful in spintronics and magnetic devices of nanoscale order. PMID:27430742

  11. Magnetism, structures and stabilities of cluster assembled TM@Si nanotubes (TM = Cr, Mn and Fe): a density functional study.

    PubMed

    Dhaka, Kapil; Bandyopadhyay, Debashis

    2016-08-01

    The present study reports transition metal (TM = Cr, Mn and Fe) doped silicon nanotubes with tunable band structures and magnetic properties by careful selection of cluster assemblies as building blocks using the first-principles density functional theory. We found that the transition metal doping and in addition, the hydrogen termination process can stabilize the pure silicon nanoclusters or cluster assemblies and then it could be extended as magnetic nanotubes with finite magnetic moments. Study of the band structures and density of states (DOS) of different empty and TM doped nanotubes (Type 1 to Type 4) show that these nanotubes are useful as metals, semiconductors, semi-metals and half-metals. These designer magnetic materials could be useful in spintronics and magnetic devices of nanoscale order.

  12. Structural and magnetic transition in stainless steel Fe-21Cr-6Ni-9Mn up to 250 GPa

    NASA Astrophysics Data System (ADS)

    Liu, Lei; Hou, Qi-Yue; Zhang, Yi; Jing, Qiu-Min; Wang, Zhi-Gang; Bi, Yan; Xu, Ji-An; Li, Xiao-Dong; Li, Yan-Chun; Liu, Jing

    2015-06-01

    Stainless steel Fe-21Cr-6Ni-9Mn (SS 21-6-9), with ˜21% Cr, ˜6% Ni, and ˜9% Mn in weight percentage, has wide applications in extensive fields. In the present study, SS 21-6-9 is compressed up to 250 GPa, and its crystal structures and compressive behaviors are investigated simultaneously using the synchrotron angle-dispersive x-ray diffraction technique. The SS 21-6-9 undergoes a structural phase transition from fcc to hcp structure at ˜12.8 GPa with neglectable volume collapse within the determination error under the quasi-hydrostatic environment. The hcp structure remains stable up to the highest pressure of 250 GPa in the present experiments. The antiferromagnetic-to-nonmagnetic state transition of hcp SS 21-6-9 with the changes of inconspicuous density and structure, is discovered at ˜50 GPa, and revealed by the significant change in c/a ratio. The hcp SS-21-6-9 is compressive anisotropic: it is more compressive in the c-axis direction than in the a-axis direction. Both the equations of states (EOSs) of fcc and hcp SS 21-6-9, which are in accordance with those of fcc and hcp pure irons respectively, are also presented. Furthermore, the c/a ratio of hcp SS 21-6-9 at infinite compression, R∞, is consistent with the values of pure iron and Fe-10Ni alloy. Project supported by the National Natural Science Foundation of China (Grant Nos. U1230201, 11274281, and 11304294), the Industrial Technology Development Program, China (Grant No. 9045140509), and the Funds from the Chinese Academy of Sciences (Grant Nos. KJCX2-SW-N03 and KJCX2-SW-N20).

  13. Multiferroic approach for Cr,Mn,Fe,Co,Ni,Cu substituted BaTiO3 nanoparticles

    NASA Astrophysics Data System (ADS)

    Verma, Kuldeep Chand; Kotnala, R. K.

    2016-05-01

    Multiferroic magnetoelectric (ME) at room temperature is significant for new design nano-scale spintronic devices. We have given a comparative study to report multiferroicity in BaTM0.01Ti0.99O3 [TM = Cr,Mn,Fe,Co,Ni,Cu (1 mol% each) substituted BaTiO3 (BTO)] nanoparticles. The TM ions influenced both nano-size and lattice distortion of Ti-O6 octahedra to the BTO. X ray diffraction study indicates that the dopant TM could influence lattice constants, distortion, tetragonal splitting of diffraction peaks (002/200) as well as peak shifting of diffraction angle in the BTO lattice. This can induce lattice strain which responsible to oxygen defects formation to mediate ferromagnetism. Also, the lattice strain effect could responsible to reduce the depolarization field of ferroelectricity and provide piezoelectric and magnetostrictive strains to enhance ME coupling. The size of BTO nanoparticles is varied in 13-51 nm with TM doping. The room temperature magnetic measurement indicates antiferromagnetic exchange interactions in BTO lattice with TM ions. The zero-field cooling and field cooling magnetic measurement at 500 Oe indicates antiferromagnetic to ferromagnetic transition. It also confirms that the substitution of Cr, Fe and Co into BTO could induce strong antiferromagnetic behavior. However, the substitutions of Mn, Ni and Cu have weak antiferromagnetic character. The temperature dependent dielectric measurements indicates polarization enhancement that influenced with both nano-size as well TM ions and exhibits ferroelectric phase transition with relaxor-like characteristics. Dynamic ME coupling is investigated, and the longitudinal ME voltage coefficient, α ME is equivalent to linear ME coupling coefficient, α (={\\varepsilon }{{o}}{\\varepsilon }{{r}}{α }{{ME}}) is also calculated.

  14. An abinitio study of the half-metallic properties of Co2TGe (T=Sc, Ti, V, Cr, Mn, Fe): LSDA+U method

    NASA Astrophysics Data System (ADS)

    Rai, D. P.; Thapa, R. K.

    2013-06-01

    Using density functional theory (DFT) calculations, we investigated the electronic and magnetic properties of the Heusler compounds Co2TGe (T = Sc, Ti, V, Cr, Mn, Fe). Among the systems under investigation Co2CrGe and Co2MnGe have given 100% spin polarization at the Fermi energy ( E F ). Co2CrGe is the most stable half-metallic ferromagnets (HMFs) with an energy gap of 0.24 eV at the Fermi level ( E F ) in spin down channel. We have also found an increase in the total magnetic moments as T goes from Sc to Fe. The calculated magnetic moments for Co2CrGe and Co2MnGe are 3.999 µ B and 5.00 µ B respectively. Based on the local spin density approximation (LSDA) calculated results, we have predicted that the compounds Co2CrGe and Co2MnGe are HMFs. We have tried to study the HMFs in Co2ScGe, Co2TiGe, Co2VGe and Co2FeGe by using the local spin density approximation and Coulomb repulsion (U) (LSDA+U) when the simple generalized gradient approximation (GGA) or the LSDA fail.

  15. Microstructures and mechanical properties of compositionally complex Co-free FeNiMnCr18 FCC solid solution alloy

    SciTech Connect

    Wu, Z.; Bei, H.

    2015-07-01

    Recently, a structurally-simple but compositionally-complex FeNiCoMnCr high entropy alloy was found to have excellent mechanical properties (e.g., high strength and ductility). To understand the potential of using high entropy alloys as structural materials for advanced nuclear reactor and power plants, it is necessary to have a thorough understanding of their structural stability and mechanical properties degradation under neutron irradiation. Furthermore, this requires us to develop a similar model alloy without Co because material with Co will make post-neutron-irradiation testing difficult due to the production of the 60Co radioisotope. In order to achieve this goal, a FCC-structured single-phase alloy with a composition of FeNiMnCr18 was successfully developed. This near-equiatomic FeNiMnCr18 alloy has good malleability and its microstructure can be controlled by thermomechanical processing. By rolling and annealing, the as-cast elongated-grained-microstructure is replaced by homogeneous equiaxed grains. The mechanical properties (e.g., strength and ductility) of the FeNiMnCr18 alloy are comparable to those of the equiatomic FeNiCoMnCr high entropy alloy. Both strength and ductility increase with decreasing deformation temperature, with the largest difference occurring between 293 and 77 K. Extensive twin-bands which are bundles of numerous individual twins are observed when it is tensile-fractured at 77 K. No twin bands are detected by EBSD for materials deformed at 293 K and higher. Ultimately the unusual temperature-dependencies of UTS and uniform elongation could be caused by the development of the dense twin substructure, twin-dislocation interactions and the interactions between primary and secondary twinning systems which result in a microstructure refinement and hence cause enhanced strain hardening and postponed necking.

  16. Thermodynamic Stability of Transition-Metal-Substituted LiMn2-x Mx O4 (M=Cr, Fe, Co, and Ni) Spinels.

    PubMed

    Lai, Chenying; Chen, Jiewei; Knight, James C; Manthiram, Arumugam; Navrotsky, Alexandra

    2016-07-01

    The formation enthalpies from binary oxides of LiMn2 O4 , LiMn2-x Crx O4 (x=0.25, 0.5, 0.75 and 1), LiMn2-x Fex O4 (x=0.25 and 0.5), LiMn2-x Cox O4 (x=0.25, 0.5, and 0.75) and LiMn1.75 Ni0.25 O4 at 25 °C were measured by high temperature oxide melt solution calorimetry and were found to be strongly exothermic. Increasing the Cr, Co, and Ni content leads to more thermodynamically stable spinels, but increasing the Fe content does not significantly affect the stability. The formation enthalpies from oxides of the fully substituted spinels, LiMnMO4 (M=Cr, Fe and Co), become more exothermic (implying increasing stability) with decreasing ionic radius of the metal and lattice parameters of the spinel. The trend in enthalpy versus metal content is roughly linear, suggesting a close-to-zero heat of mixing in LiMn2 O4 -LiMnMO4 solid solutions. These data confirm that transition-metal doping is beneficial for stabilizing these potential cathode materials for lithium-ion batteries.

  17. Thermodynamic Stability of Transition-Metal-Substituted LiMn2-x Mx O4 (M=Cr, Fe, Co, and Ni) Spinels.

    PubMed

    Lai, Chenying; Chen, Jiewei; Knight, James C; Manthiram, Arumugam; Navrotsky, Alexandra

    2016-07-01

    The formation enthalpies from binary oxides of LiMn2 O4 , LiMn2-x Crx O4 (x=0.25, 0.5, 0.75 and 1), LiMn2-x Fex O4 (x=0.25 and 0.5), LiMn2-x Cox O4 (x=0.25, 0.5, and 0.75) and LiMn1.75 Ni0.25 O4 at 25 °C were measured by high temperature oxide melt solution calorimetry and were found to be strongly exothermic. Increasing the Cr, Co, and Ni content leads to more thermodynamically stable spinels, but increasing the Fe content does not significantly affect the stability. The formation enthalpies from oxides of the fully substituted spinels, LiMnMO4 (M=Cr, Fe and Co), become more exothermic (implying increasing stability) with decreasing ionic radius of the metal and lattice parameters of the spinel. The trend in enthalpy versus metal content is roughly linear, suggesting a close-to-zero heat of mixing in LiMn2 O4 -LiMnMO4 solid solutions. These data confirm that transition-metal doping is beneficial for stabilizing these potential cathode materials for lithium-ion batteries. PMID:27017448

  18. Elastic properties of fcc Fe-Mn-X (X = Cr, Co, Ni, Cu) alloys studied by the combinatorial thin film approach and ab initio calculations.

    PubMed

    Reeh, S; Kasprzak, M; Klusmann, C D; Stalf, F; Music, D; Ekholm, M; Abrikosov, I A; Schneider, J M

    2013-06-19

    The elastic properties of fcc Fe-Mn-X (X = Cr, Co, Ni, Cu) alloys with additions of up to 8 at.% X were studied by combinatorial thin film growth and characterization and by ab initio calculations using the disordered local moments (DLM) approach. The lattice parameter and Young's modulus values change only marginally with X. The calculations and experiments are in good agreement. We demonstrate that the elastic properties of transition metal alloyed Fe-Mn can be predicted by the DLM model.

  19. Novel High-Speed High Pressure Torsion Technology for Obtaining Fe-Mn-Si-Cr Shape Memory Alloy Active Elements

    NASA Astrophysics Data System (ADS)

    Gurău, Gheorghe; Gurău, Carmela; Potecaşu, Octavian; Alexandru, Petrică; Bujoreanu, Leandru-Gheorghe

    2014-07-01

    This paper introduces an adapted high-speed high pressure torsion (HS-HPT) method of severe plastic deformation applied for obtaining shape memory alloy (SMA) active elements with revolution symmetry, able to develop axial displacement/force. Billets with circular crown forms were cut from Fe-28Mn-6Si-5Cr (mass%) SMA ingots and, by means of HS-HPT technology, were directly turned into modules, with truncated cone shell configurations. This process was performed, during time intervals of seconds, under the effect of high pressure (up to 1 GPa) cumulated with high rotation speed (hundreds of rotations per minute) applied on the active surfaces of sintered-carbide anvils, specially designed for this purpose. Due to pressure and friction, generated by rotation, the entire sample volume is heated and simultaneously deformed to final shape. During the process, microstructure fragmentation occurred enabling to obtain (ultra)fine grains and nanocrystalline areas, in spite of the heat developed by friction, which was removed by conduction at the contact surface between sample and anvils, before the occurrence of any recrystallization phenomena. When compressed between flat surfaces, the truncated cone modules developed a superelastic-like response, unique among Fe -Mn-Si base SMAs and, when heated in compressed state, they were able to develop either axial strokes or recovery forces by either free or constrained recovery shape memory effect (SME), respectively. By means of optical (OM) and scanning electron microscopy (SEM) marked structural changes caused by HT-HPT were revealed, along with fine and ultrafine crystalline grains. The presence of stress-induced ɛ-hexagonal close-packed ( hcp) martensite, together with nanocrystalline areas were confirmed by x-ray diffraction.

  20. Magnetism and superconductivity in MxFe1+yTe1-zSez (M = Cr, Mn, Co, Ni, Cu, and Zn) single crystals

    NASA Astrophysics Data System (ADS)

    Zhang, Z. T.; Yang, Z. R.; Li, L.; Zhang, C. J.; Pi, L.; Tan, S.; Zhang, Y. H.

    2011-04-01

    High-quality single crystals with nominal composition M0.05Fe0.95Te0.8Se0.2 (M = Cr, Mn, Co, Ni, Cu, and Zn) have been grown, through which the doping effect on magnetism and superconductivity is studied. Elementary analysis reveals that Cu, Co, and Ni, with smaller ionic radii for valence state 2+, can substitute effectively for Fe with doping levels near 5%. In contrast, the solid solution of Cr, Mn, and Zn in the host system is low. Magnetic and electronic investigations show that the substitution of Co, Ni, or Cu for Fe leads to the formation of spin-glass state and suppression of superconductivity. The superconductivity is partly suppressed by Co doping, while completely destroyed by Ni and Cu doping. Compared with Cu- and Ni-doped samples, the Co-doped sample has the smallest lattice constant, indicating that the superconductivity might be also modulated by the changes of microstructure.

  1. Phytoremediation of Cd, Cr, Cu, Mn, Fe, Ni, Pb and Zn from aqueous solution using Phragmites cummunis, Typha angustifolia and Cyperus esculentus.

    PubMed

    Chandra, Ram; Yadav, Sangeeta

    2011-07-01

    A comparative bioaccumulation pattern and ultra structural changes were studied in Phragmites cummunis, Typha angustifolia and Cyperus esculentus in mixed metals solution of cadmium (Cd), chromium (Cr), copper (Cu), iron (Fe), manganese (Mn), nickel (Ni), lead (Pb) and zinc (Zn). P. cummunis was observed to be a shoot accumulator for Cr, Fe, Mn, Ni, Pb, and Zn. However, T. angustifolia was found to be a root accumulator for Cd, Cr, Cu, Fe, Ni and Pb. In addition, C. esculentus also accumulated most of the tested heavy metals in the roots, while Mn and Fe were translocated up to leaves. Further, the long term metal treatment showed maximum accumulation of all heavy metals in P. cummunis followed by T. angustifolia and C. esculentus. Among heavy metals, Fe was accumulated maximum, i.e., >1000 microg g(-1) by all three plants. Simultaneously, the adverse effects on biochemical parameters were noted earlier in C. esculentus than T. angustifolia and P. cummunis. Ultra structural observation showed the cellular changes in wetland plants after longer exposure. Results revealed that P. cummunis and T. angustifolia had more potential for tested metals than C. esculentus. This study established that these wetland plants could be used for heavy metals phytoremediation from metal containing industrial wastewater. PMID:21972504

  2. Microstructural stability and mechanical behavior of FeNiMnCr high entropy alloy under ion irradiation

    DOE PAGESBeta

    Leonard, Keith J.; Bei, Hongbin; Zinkle, Steven J.; Kiran Kumar, N. A. P.; Li, C.

    2016-05-13

    In recent years, high entropy alloys (HEAs) have attracted significant attention due to their excellent mechanical properties and good corrosion resistance, making them potential candidates for high temperature fission and fusion structural applications. However there is very little known about their radiation resistance, particularly at elevated temperatures relevant for energy applications. In the present study, a single phase (face centered cubic) concentrated solid solution alloy of composition 27%Fe-28%Ni-27%Mn-18%Cr was irradiated with 3 or 5.8 MeV Ni ions at temperatures ranging from room temperature to 700 °C and midrange doses from 0.03 to 10 displacements per atom (dpa). Transmission electron microscopymore » (TEM), scanning transmission electron microscopy with energy dispersive x-ray spectrometry (STEM/EDS) and X-ray diffraction (XRD) were used to characterize the radiation defects and microstructural changes. Irradiation at higher temperatures showed evidence of relatively sluggish solute diffusion with limited solute depletion or enrichment at grain boundaries. The main microstructural feature at all temperatures was high-density small dislocation loops. Voids were not observed at any irradiation condition. Nano-indentation tests on specimens irradiated at room temperature showed a rapid increase in hardness ~35% and ~80% higher than the unirradiated value at 0.03 and 0.3 dpa midrange doses, respectively. The irradiation-induced hardening was less pronounced for 500 °C irradiations (<20% increase after 3 dpa). Overall, the examined HEA material exhibits superior radiation resistance compared to conventional single phase Fe-Cr-Ni austenitic alloys such as stainless steels. Furthermore, the present study provides insight on the fundamental irradiation behavior of a single phase HEA material over a broad range of irradiation temperatures.« less

  3. Minisatellite DNA mutation rate in dandelions increases with leaf-tissue concentrations of Cr, Fe, Mn, and Ni.

    PubMed

    Rogstad, Steven H; Keane, Brian; Collier, Matthew H

    2003-09-01

    We have examined whether mutation rates at minisatellite DNA loci in dandelions (Taraxacum officinale Weber, sensu lato: Asteraceae) increase with increasing exposure to metal pollution. From 16 sites (Colorado to Pennsylvania, USA) covering a range of airborne particulate-matter exposures, soil metal concentrations, and leaf-tissue metal concentrations, we grew an average of 7.9 offspring from each of 10 parent plants, and we analyzed the parent-offspring transmission of 82,715 minisatellite DNA markers to 1,258 offspring for rates of mutation. The mean number of markers examined per individual (using six minisatellite probes) was 65.8. Detection of mutations is facilitated by agamospermous reproduction (clonal seed production) in dandelions. Across sites, the average single-event, parent-offspring marker transmission mutation rate was 0.0067, ranging from 0.002 to 0.015 (a 7.5-fold difference). No significant correlation was detected between site single-event mutation rates and either airborne particulate-matter or soil concentrations for any of the metals. However, across sites, mutation rates were significantly (p < 0.05) and positively correlated to increasing leaf-tissue concentrations of Cr, Fe, Mn, and Ni (Cd, Cu, Pb, and Zn exhibited no correlation). Multiple-regression analyses suggest that a model including three metals--in order of importance: Cr (p = 0.002), Fe (p = 0.02), and Ni (p = 0.005); overall, p = 0.001--may improve the ability to predict mutation rate relative to leaf metal concentrations in dandelions. Mutations at minisatellite DNA loci in sexually apomictic organisms may thus provide convenient biomarkers by which to assess the mutagen stressor risk in environments.

  4. Lunar highland rocks - Element partitioning among minerals. II - Electron microprobe analyses of Al, P, Ca, Ti, Cr, Mn and Fe in olivine

    NASA Technical Reports Server (NTRS)

    Smith, J. V.; Hansen, E. C.; Steele, I. M.

    1980-01-01

    Lunar olivines from anorthosites, granulitic impactites, and rocks in the Mg-rich plutonic trend were subjected to electron probe measurements for Al, P, Ca, Ti, Cr and Mn, which show that the FeO/MnO ratio for lunar olivines lies between 80 and 110 with little difference among the rock types. The low values of Ca in lunar olivines indicate slow cooling to subsolidus temperatures, with blocking temperatures of about 750 C for 67667 and 1000 C for 60255,73-alpha determined by the Finnerty and Boyd (1978) experiments. An important paradox is noted in the low Ti content of Fe-rich olivines from anorthosites, although both Ti and Fe tend to become enriched in liquid during fractional distillation. Except for Ca and Mn, olivine from anorthosites has lower minor element values than other rock types. Formation from a chemically distinct system is therefore implied.

  5. Nanoscale origins of the damage tolerance of the high-entropy alloy CrMnFeCoNi

    SciTech Connect

    Zhang, ZiJiao; Mao, M. M.; Wang, Jiangwei; Gludovatz, Bernd; Zhang, Ze; Mao, Scott X.; George, Easo P.; Yu, Qian; Ritchie, Robert O.

    2015-12-09

    Damage tolerance can be an elusive characteristic of structural materials requiring both high strength and ductility, properties that are often mutually exclusive. High-entropy alloys are of interest in this regard. Specifically, the single-phase CrMnFeCoNi alloy displays tensile strength levels of ~1 GPa, excellent ductility (~60–70%) and exceptional fracture toughness (KJIc>200M Pa√m). Here through the use of in situ straining in an aberration-corrected transmission electron microscope, we report on the salient atomistic to micro-scale mechanisms underlying the origin of these properties. We identify a synergy of multiple deformation mechanisms, rarely achieved in metallic alloys, which generates high strength, work hardening and ductility, including the easy motion of Shockley partials, their interactions to form stacking-fault parallelepipeds, and arrest at planar slip bands of undissociated dislocations. In conclusion, we further show that crack propagation is impeded by twinned, nanoscale bridges that form between the near-tip crack faces and delay fracture by shielding the crack tip.

  6. Nanoscale origins of the damage tolerance of the high-entropy alloy CrMnFeCoNi

    DOE PAGESBeta

    Zhang, ZiJiao; Mao, M. M.; Wang, Jiangwei; Gludovatz, Bernd; Zhang, Ze; Mao, Scott X.; George, Easo P.; Yu, Qian; Ritchie, Robert O.

    2015-12-09

    Damage tolerance can be an elusive characteristic of structural materials requiring both high strength and ductility, properties that are often mutually exclusive. High-entropy alloys are of interest in this regard. Specifically, the single-phase CrMnFeCoNi alloy displays tensile strength levels of ~1 GPa, excellent ductility (~60–70%) and exceptional fracture toughness (KJIc>200M Pa√m). Here through the use of in situ straining in an aberration-corrected transmission electron microscope, we report on the salient atomistic to micro-scale mechanisms underlying the origin of these properties. We identify a synergy of multiple deformation mechanisms, rarely achieved in metallic alloys, which generates high strength, work hardening andmore » ductility, including the easy motion of Shockley partials, their interactions to form stacking-fault parallelepipeds, and arrest at planar slip bands of undissociated dislocations. In conclusion, we further show that crack propagation is impeded by twinned, nanoscale bridges that form between the near-tip crack faces and delay fracture by shielding the crack tip.« less

  7. Nanoscale origins of the damage tolerance of the high-entropy alloy CrMnFeCoNi

    PubMed Central

    Zhang, ZiJiao; Mao, M. M.; Wang, Jiangwei; Gludovatz, Bernd; Zhang, Ze; Mao, Scott X.; George, Easo P.; Yu, Qian; Ritchie, Robert O.

    2015-01-01

    Damage tolerance can be an elusive characteristic of structural materials requiring both high strength and ductility, properties that are often mutually exclusive. High-entropy alloys are of interest in this regard. Specifically, the single-phase CrMnFeCoNi alloy displays tensile strength levels of ∼1 GPa, excellent ductility (∼60–70%) and exceptional fracture toughness (KJIc>200 MPa√m). Here through the use of in situ straining in an aberration-corrected transmission electron microscope, we report on the salient atomistic to micro-scale mechanisms underlying the origin of these properties. We identify a synergy of multiple deformation mechanisms, rarely achieved in metallic alloys, which generates high strength, work hardening and ductility, including the easy motion of Shockley partials, their interactions to form stacking-fault parallelepipeds, and arrest at planar slip bands of undissociated dislocations. We further show that crack propagation is impeded by twinned, nanoscale bridges that form between the near-tip crack faces and delay fracture by shielding the crack tip. PMID:26647978

  8. Crystallography and elastic energy analysis of VN precipitates in Fe-Mn-Si-Cr shape memory alloys

    SciTech Connect

    Farjami, Susan . E-mail: sfarjami@stu.material.tohoku.ac.jp; Hiraga, Kenji; Kubo, Hiroshi

    2005-01-10

    High-resolution electron microscopy investigations are carried out to describe the morphology and crystallography of VN precipitates which are formed in an Fe-28Mn-6Si-5Cr (mass%) shape memory alloy. It is revealed that the shape change from a cube with (1 0 0) interfaces to an octahedral shape with (1 1 1) interfaces occurs on aging in the precipitate. In order to identify the equilibrium shape of the VN precipitate, elastic strain energy of the precipitate has been estimated on the basis of microscopic theory of elasticity. It is found that a coherent precipitate ({approx}4 nm in edge width) in a cube shape with (1 0 0) surfaces can be formed, at an early stage of precipitation, with no misfit dislocations existing at the interface of the precipitate. It is also shown that the octahedral-shaped precipitate ({approx}15 nm in edge width) has a minimum elastic energy, among the cube-shaped, sphere-shaped and octahedron-shaped precipitates, only when the misfit dislocations are introduced at the interfaces. The elastic interaction energy between the misfit dislocations and the precipitate-misfit dislocations is estimated for the first time using the Fourier transformed microscopic theory of elasticity.

  9. Thermal Behavior of Mechanically Alloyed Powders Used for Producing an Fe-Mn-Si-Cr-Ni Shape Memory Alloy

    NASA Astrophysics Data System (ADS)

    Pricop, B.; Söyler, U.; Lohan, N. M.; Özkal, B.; Bujoreanu, L. G.; Chicet, D.; Munteanu, C.

    2012-11-01

    In order to produce shape memory rings for constrained-recovery pipe couplings, from Fe-14 Mn-6 Si-9 Cr-5 Ni (mass%) powders, the main technological steps were (i) mechanical alloying, (ii) sintering, (iii) hot rolling, (iv) hot-shape setting, and (v) thermomechanical training. The article generally describes, within its experimental-procedure section, the last four technological steps of this process the primary purpose of which has been to accurately control both chemical composition and the grain size of shape memory rings. Details of the results obtained in the first technological step, on raw powders employed both in an initial commercial state and in a mixture state of commercial and mechanically alloyed (MA) powders, which were subjected to several heating-cooling cycles have been reported and discussed. By means of differential scanning calorimetry (DSC), scanning electron microscopy (SEM), and X-ray diffraction (XRD), the thermal behaviors of the two sample powders have been analyzed. The effects of the heating-cooling cycles, on raw commercial powders and on 50% MA powders, respectively, were argued from the point of view of specific temperatures and heat variations, of elemental diffusion after thermal cycling and of crystallographic parameters, determined by DSC, SEM, and XRD, respectively.

  10. Decay Data Evaluation Project (DDEP): Updated decay data evaluations for (24)Na, (46)Sc, (51)Cr, (54)Mn, (57)Co, (59)Fe, (88)Y, (198)Au.

    PubMed

    Chechev, Valery P; Kuzmenko, Nikolay K

    2016-03-01

    Updated DDEP evaluations have been presented for the decay characteristics of the radionuclides (24)Na, (46)Sc, (51)Cr, (54)Mn, (57)Co, (59)Fe, (88)Y and (198)Au. Previous DDEP evaluations for these radionuclides were published in the BIPM-5 monographie in 2004. The experimental data published during the intervening period of 2004-2014 were taken into account in the current evaluations as well as other information: new compilations, analyses, and corrections. The updated evaluations are compared to previous results.

  11. Temperature dependencies of the elastic moduli and thermal expansion coefficient of an equiatomic, single-phase CoCrFeMnNi high-entropy alloy

    DOE PAGESBeta

    Laplanche, G.; Gadaud, P.; Horst, O.; Otto, F.; Eggeler, G.; George, E.

    2014-11-15

    The equiatomic CoCrFeMnNi alloy is now regarded as a model face-centered cubic single-phase high-entropy alloy. Consequently, determination of its intrinsic properties such as the temperature dependencies of elastic moduli and thermal expansion coefficient are important to improve understanding of this new class of material. Lastly, these temperature dependencies were measured over a large temperature range (200–1270 K) in this study.

  12. [Study on the method for the determination of Fe, Si, Cu, Mg, Mn, Ni, Zn, Ti, Cr, Sr in aluminium alloy by ICP-AES].

    PubMed

    Zhong, Zhi-guang; Bian, Qun-zhou; Zheng, Jian-guo; Chen, Pei-ling; Liu, Chong-hua; Wei, Xian-ying

    2002-02-01

    The method for the determination of Fe, Mn, Cu, Zn, Mg, Ti, Si, Ni, Cr, Sr in aluminum alloy has been developed in this study. The sample was dissolved with sodium hydroxide, the matrix interference and interference among tested elements were studied and then corrected by matrix match and interference coefficient respectively. The method is rapid, simple and accurate, and it is suitable for daily testing of aluminum alloy for import and export.

  13. The Mechanical and Corrosion Behaviors of As-cast and Re-melted AlCrCuFeMnNi Multi-Component High-Entropy Alloy

    NASA Astrophysics Data System (ADS)

    Soare, Vasile; Mitrica, Dumitru; Constantin, Ionut; Popescu, Gabriela; Csaki, Ioana; Tarcolea, Mihai; Carcea, Ioan

    2015-04-01

    A multi-component AlCrCuFeMnNi high-entropy alloy, prepared by vacuum induction melting, was investigated for structural, mechanical, and corrosion characteristics, before and after the re-melting process. Optical microscopy analysis revealed a dendritic solidification behavior. The interdendritic area contains two main phases and occasionally small hard phases. The re-melting process produced a finer dendritic structure, with rounded dendrites and reduced interdendritic hard phases. The SEM-EDAX analysis showed that the dendrite region contains a Widmanstatten type of structure and are composed of Cr-Fe rich phases, whereas the interdendrite region contains Cu and Mn rich phases. XRD analysis revealed two disordered BCC type A2 structures with high Cr and Fe content and an FCC A12 type of structure for the Cu and Mn rich interdendritic phase. The lattice constants, determined by X-ray diffraction, are 2.87 and 2.91 Å for the A2 phases and 3.67 Å for A1 phase. The Vickers micro hardness increased with the homogeneity of the alloy, having a maximum value of 4370 MPa for the re-melted sample. Corrosion tests carried out in 3.5 wt pct sodium chloride aerated solution indicated that the corrosion resistance improved with the re-melting process, being 1.5 to 2 times better than that of 304 stainless steel.

  14. Density functional theory study of Mo-doped M@(BN)48 (M = Sc, Ti, V, Cr, Mn, Fe, Co, Ni, and Cu) clusters

    NASA Astrophysics Data System (ADS)

    Liang, Wenjuan; Jia, Jianfeng; Lv, Jin; Wu, Haishun

    2016-03-01

    The structure and magnetic properties of Mo-doped M@(BN)48 (M = Sc, Ti, V, Cr, Mn, Fe, Co, Ni, and Cu) clusters were calculated at BPW91/LanL2DZ level. The magnetic nature of the clusters M@(BN)48 significantly changed when doping with Mo atom, except for Co@(BN)48. Only the magnetic moment for the CrMo@(BN)48 cluster was decreased to zero. Thus, M@(BN)48 clusters can be selected as the model system to detect Mo atom by the change of the magnetic moment.

  15. Molecular structure and biological studies on Cr(III), Mn(II) and Fe(III) complexes of heterocyclic carbohydrazone ligand

    NASA Astrophysics Data System (ADS)

    Abu El-Reash, G. M.; El-Gammal, O. A.; Radwan, A. H.

    2014-03-01

    The chelating behavior of the ligand (H2APC) based on carbohydrazone core modified with pyridine end towards Cr(III), Mn(II) and Fe(III) ions have been examined. The 1H NMR and IR data for H2APC revealed the presence of two stereoisomers syn and anti in both solid state and in solution in addition to the tautomeric versatility based on the flexible nature of the hydrazone linkage leading to varied coordination modes. The spectroscopic data confirmed that the ligand behaves as a monobasic tridentate in Cr(III) and Fe(III) complexes and as neutral tetradentate in Mn(II) complex. The electronic spectra as well as the magnetic measurements confirmed the octahedral geometry for all complexes. The bond length and angles were evaluated by DFT method using material studio program for all complexes. The thermal behavior and the kinetic parameters of degradation were determined using Coats-Redfern and Horowitz-Metzger methods. The antioxidant (DDPH and ABTS methods), anti-hemolytic and cytotoxic activities of the compounds have been screened. Cr(III) complex and H2APC showed the highest antioxidant activity using ABTS and DPPH methods. With respect to in vitro Ehrlich ascites assay, H2APC exhibited the potent activity followed by Fe(III) and Cr(III)complexes.

  16. Characterization of a New Fe-C-Mn-Si-Cr Bearing Alloy: Tempered Martensite Embrittlement Susceptibility

    NASA Astrophysics Data System (ADS)

    Marcomini, J. B.; Goldenstein, H.

    2014-03-01

    Bearing steels containing 1% C and 1.5% Cr have been the usual material of choice for machine components submitted to rolling and contact fatigue, for more than a century. As a rule these steels are quenched from the intercritical gamma + carbide region and tempered at low temperatures (less than 250 °C), in order to retain the high hardness of the martensite matrix and avoid the tempered martensite embrittlement (TME) phenomena, which compromise the toughness of steels tempered at higher temperatures. A new high Si alloy was developed for bearing applications. The inhibiting and/or retarding effect of Si on the kinetics of cementite precipitation leads to a higher temperature of TME occurrence, allowing the tempering of the components at a higher temperature, thus increasing the toughness, without sacrificing the high hardness. The purpose of this work was to confirm the TME resistance of the new alloy. In this work, impact tests result for commercial SAE/AISI 52100 (0.25% Si) and for a modified 52100 containing 1.74% Si, were compared. No evidence of TME was detected on the Si-modified steel.

  17. Zoned chromites with high Mn-contents in the Fe-Ni-Cr-laterite ore deposits from the Edessa area in Northern Greece

    NASA Astrophysics Data System (ADS)

    Michailidis, K. M.

    1990-07-01

    The mineralogy of the transported Fe-Ni-Cr-laterite ore bodies from the Edessa area in Northern Greece was studied. The special emphasis was on the textural features and chemistry of chromite. The chromite was residually inherited in laterites from weathered ultramafic rocks and it displays zonation. Three main zones were optically distinguished: an inner chromite zone, an intermediate ferritechromite zone and a magnetite rim. These three zones have distinct compositions. The major oxides MgO and Al2O3 decrease from the chromite core to the ferritechromite zone, while FeOt increases and Cr2O3 either increases or decreases. A characteristic chemical feature of the chromite is the very high Mn-content in the ferritechromite zone, up to 20%wt MnO. Chemical zonation has, however, been detected in optically unzoned chromite cores rimmed by magnetite. The zoning and the high Mn-content of the chromite is a result of serpentinization in the presence of Mn-rich fluids, following lateritic weathering and finally Alpine low-grade metamorphism.

  18. Statistical theory of diffusion in concentrated bcc and fcc alloys and concentration dependencies of diffusion coefficients in bcc alloys FeCu, FeMn, FeNi, and FeCr

    NASA Astrophysics Data System (ADS)

    Vaks, V. G.; Khromov, K. Yu.; Pankratov, I. R.; Popov, V. V.

    2016-07-01

    The statistical theory of diffusion in concentrated bcc and fcc alloys with arbitrary pairwise interatomic interactions based on the master equation approach is developed. Vacancy-atom correlations are described using both the second-shell-jump and the nearest-neighbor-jump approximations which are shown to be usually sufficiently accurate. General expressions for Onsager coefficients in terms of microscopic interatomic interactions and some statistical averages are given. Both the analytical kinetic mean-field and the Monte Carlo methods for finding these averages are described. The theory developed is used to describe sharp concentration dependencies of diffusion coefficients in several iron-based alloy systems. For the bcc alloys FeCu, FeMn, and FeNi, we predict the notable increase of the iron self-diffusion coefficient with solute concentration c, up to several times, even though values of c possible for these alloys do not exceed some percent. For the bcc alloys FeCr at high temperatures T ≳ 1400 K, we show that the very strong and peculiar concentration dependencies of both tracer and chemical diffusion coefficients observed in these alloys can be naturally explained by the theory, without invoking exotic models discussed earlier.

  19. Influence of the addition of transition metals (Cr, Zr, Mo) on the properties of MnOx-FeOx catalysts for low-temperature selective catalytic reduction of NOx by Ammonia.

    PubMed

    Zhou, Changcheng; Zhang, Yaping; Wang, Xiaolei; Xu, Haitao; Sun, Keqin; Shen, Kai

    2013-02-15

    The co-precipitation and citric acid methods were employed to prepare MnO(x)-FeO(x) catalysts for the low-temperature selective catalytic reduction (SCR) of NO(x) by ammonia. It was found that the Mn-Fe (CP) sample obtained from the co-precipitation method, which exhibited low crystalline of manganese oxides on the surface, high specific surface area and abundant acid sites at the surface, had better catalytic activity. The effects of doping different transition metals (Mo, Zr, Cr) in the Mn-Fe (CP) catalysts were further investigated. The study suggested that the addition of Cr can obviously reduce the take-off temperature of Mn-Fe catalyst to 90°C, while the impregnation of Zr and Mo raised that remarkably. The texture and micro-structure analysis revealed that for the Cr-doped Mn-Fe catalysts, the active components had better dispersion with less agglomeration and sintering and the largest BET surface specific area. In situ FTIR study indicated that the addition of Cr can increase significantly the surface acidity, especially, the Lewis acid sites, and promote the formation of the intermediate -NH(3)(+). H(2)-TPR results confirmed the better low-temperature redox properties of Mn-Fe-Cr.

  20. Optical and dielectric properties of BiMn1-xAExO3 (AE=Cr, Fe, Co, and Zn; x=0, 0.1) nanoparticles synthesized by sol-gel technique

    NASA Astrophysics Data System (ADS)

    Bhardwaj, Neha; Gaur, Anurag; Yadav, Kamlesh

    2015-08-01

    BiMnO3 is a multiferroic material which means that it shows both the ferroelectricity and ferromagnetism. Present study deals about the study of optical and dielectric properties of BiMnO3 and doped BiMnO3. The magnetic and non magnetic ions are introduced as dopants in place of Mn sublattice, BiMn1-xAExO3 (where x=0.1 and AE= Cr, Fe, Co, and Zn). We have synthesized nanoparticles of BiMnO3 and BiMn1-xAExO3 (where x=0.1 and AE= Cr, Fe, Co, and Zn) by sol-gel technique. Optical properties have been studied by using FTIR (Fourier Transform Infrared) spectroscopy. FTIR (Fourier Transform Infrared Spectroscopy) analysis showed that there is an increase in the band gap of BiMn1-xAExO3 (where x=0.1 and AE= Cr, Fe, Co, and Zn) than pure BiMnO3 for the samples synthesized by sol-gel technique. The increase in band gap on doping is due to the radius to charge ratio. Ferroelectric hysteresis loop confirms the presence of ferroelectricity in BiMnO3. From the ferroelectric hysteresis loop the parameters like coericivity, saturation polarization and remanant polarization has been calculated. Nanoparticles of BiMnO3 have applications in memory storage devices.

  1. Single-ion anisotropy and exchange interactions in the cyano-bridged trimers MnIII2MIII(CN)6 (MIII = Co, Cr, Fe) species incorporating [Mn(5-Brsalen)]+ units: an inelastic neutron scattering and magnetic susceptibility study.

    PubMed

    Tregenna-Piggott, Philip L W; Sheptyakov, Denis; Keller, Lukas; Klokishner, Sophia I; Ostrovsky, Sergei M; Palii, Andrei V; Reu, Oleg S; Bendix, Jesper; Brock-Nannestad, Theis; Pedersen, Kasper; Weihe, Høgni; Mutka, Hannu

    2009-01-01

    The electronic structures of the compounds K[(5-Brsalen)(2)(H(2)O)(2)-Mn(2)M(III)(CN)(6)].2H(2)O (M(III) = Co(III), Cr(III), Fe(III)) have been determined by inelastic neutron scattering (INS) and magnetic susceptibility studies, revealing the manganese(III) single-ion anisotropy and exchange interactions that define the low-lying states of the Mn-M(III)-Mn trimeric units. Despite the presence of an antiferromagnetic intertrimer interaction, the experimental evidence supports the classification of both the Cr(III) and Fe(III) compounds as single-molecule magnets. The value of 17(2) cm(-1) established from AC susceptibility measurements for a spin-reversal barrier of K[(5-Brsalen)(2)(H(2)O)(2)-Mn(2)Cr(CN)(6)].2H(2)O may be readily rationalized in terms of the energy level diagram determined directly by INS. AC susceptibility measurements on samples of K[(5-Brsalen)(2)(H(2)O)(2)-Mn(2)Fe(CN)(6)].2H(2)O are contrary to those previously reported, exhibiting but the onset of peaks below temperatures of 1.8 K at oscillating frequencies in the range of 100-800 Hz. INS measurements reveal an anisotropic ferromagnetic manganese(III)-iron(III) exchange interaction, in accordance with theoretical expectations based on the unquenched orbital angular momentum of the [Fe(CN)(6)](3-) anion, giving rise to an M(s) approximately +/-9/2 ground state, isolated by approximately 11.5 cm(-1) from the higher-lying levels. The reported INS and magnetic data should now serve as a benchmark against which theoretical models that aim to inter-relate the electronic and molecular structure of molecular magnets should be tested. PMID:19035636

  2. Microstructures and Mechanical Performance of Plasma-Nitrided Al0.3CrFe1.5MnNi0.5 High-Entropy Alloys

    NASA Astrophysics Data System (ADS)

    Tang, Wei-Yeh; Chuang, Ming-Hao; Lin, Su-Jien; Yeh, Jien-Wei

    2012-07-01

    This study investigates the effect of plasma nitriding at 798 K (525 °C) on microstructures and the mechanical performance of Al0.3CrFe1.5MnNi0.5 high-entropy alloys (HEAs) obtained using different cast and wrought processing. All the alloys can be well nitride, with a thickness of around 80 μm, and attain a peak hardness level around Hv 1300 near the surface. The main nitride phases are CrN, AlN, and (Mn, Fe)4N. Those of the substrates are bcc, fcc, Al-, and Ni-rich B2 precipitates, and ρ phase. Their relative amounts depend on the prior processing and also change under the heat treatment during nitriding. The formation of ρ phase during nitriding could in-situ harden the substrate to attain the suitable level required for wear applications. This gives the advantage in simplifying the processing for making a wear-resistance component or a mold since austenitizing, quench hardening, and tempering required for steels such as SACM and SKD steels are no longer required and final finishing can be accomplished before nitriding. Nitrided Al0.3CrFe1.5MnNi0.5 samples have much better wear resistance than un-nitrided ones by 49 to 80 times and also exhibit superior adhesive wear resistance to conventional nitrided alloys: nitriding steel SACM-645 (AISI 7140), 316 stainless steel, and hot-mold steel SKD-61 (AISI H13) by 22 to 55 times depending on prior processing. The superiority is due to the fact that the present nitrided alloys possess a much thicker highly hardened layer than the conventional alloys.

  3. Specific features of the electrical resistivity of half-metallic ferromagnets Co2 MeAl ( Me = Ti, V, Cr, Mn, Fe)

    NASA Astrophysics Data System (ADS)

    Kourov, N. I.; Perevozchikova, Yu. A.; Weber, H. W.; Marchenkov, V. V.

    2016-07-01

    The transport properties of half-metallic ferromagnetic Heusler alloys Co2 MeAl ( Me = Ti, V, Cr, Mn, Fe are transition 3 d metals) have been measured in the temperature range of 4-900 K. The specific features of the behavior of the resistivity have been considered in the framework of the two-current model of conductivity that takes into account the existence of the energy gap in the electronic spectra of the alloys near the Fermi level of one of electron subbands that differs in the spin direction.

  4. A Novel Training-Free Processed Fe-Mn-Si-Cr-Ni Shape Memory Alloy Undergoing δ → γ Phase Transformation

    NASA Astrophysics Data System (ADS)

    Peng, Huabei; Wang, Gaixia; Du, Yangyang; Wang, Shanling; Chen, Jie; Wen, Yuhua

    2016-07-01

    We not only suppress the formation of twin boundaries but also introduce a high density of stacking faults by taking advantage of δ → γ phase transformation in a processed Fe-19.38Mn-5.29Si-8.98Cr-4.83Ni shape memory alloy. As a result, its shape memory effect is remarkably improved after heating at 1533 K (1260 °C) (single-phase region of δ ferrite) and air cooling due to δ → γ phase transformation.

  5. Coupling between magnetic and optical properties of GaN:TM (TM: V, Cr, Mn, Fe, Co, Ni): First-principle study with LDA-SIC approximation

    NASA Astrophysics Data System (ADS)

    Salmani, El mehdi; Mounkachi, Omar; Ez-Zahraouy, Hamid; Benyoussef, Abdelilah; Hamedoun, Mohammed; Hlil, El kebir

    2013-11-01

    Electronic structure, magnetic and optical properties of GaN:TM (TM: V, Cr, Mn, Fe, Co, Ni), based dilute magnetic semiconductors (DMS), are investigated using first-principles calculations. The energy difference between the ferromagnetic and disorder local moment states has been evaluated. Moreover, the optical absorption spectra obtained by ab-initio calculations confirm the ferromagnetic stability based on the charge state of magnetic impurities. Our results show that the ferromagnetic state is stable when TM introduce simultaneously magnetic moment and intrinsic carriers in (Ga, TM)N. Some studied ferromagnetic DMS exhibit half-metallic behavior, which is suitable for spintronics applications.

  6. Influence of roll and solution treatment processing on shape memory effect of Fe-14Mn-5Si-9Cr-5Ni alloy

    SciTech Connect

    Li, C.L.; Jin, Z.H.

    1998-10-01

    The shape memory effect was studied in an Fe-14Mn-5Si-9Cr-5Ni alloy rerolled at 1123 K after hot rolling at 1423 K, followed by solution treatment at different temperatures. It was found that the alloy exhibits a maximum degree of shape recovery in a bending test and a complete recovery tensile strain of 2.2% in samples that were solution heated at 973 K for 600 s and then quenched in water. The rerolled processing at 1123 K after hot rolling at 1423 K and the microstructure under solution treatment state are important for obtaining a good shape memory effect in the alloy.

  7. Catalytic oxidation of 2-Propanol over (Cr,Mn,Fe)-Pt/gamma-Al2O3 bimetallic catalysts and modeling of experimental results by artificial neural networks.

    PubMed

    Niaei, A; Salari, D; Aghazadeh, F; Caylak, N; Sepehrianazar, A

    2010-01-01

    The catalytic activity of transition metals (Cr,Mn,Fe) supported on the Pt/gamma -Al(2)O(3) industrial catalyst was investigated to bring about the complete oxidation of 2-Propanol. Catalytic studies were carried out under atmospheric pressure in a fixed bed reactor. X-ray diffraction (XRD), Scanning electron microscopy (SEM), Transmission electron microscopy (TEM) and ICP-AES techniques were used to characterize a series of catalysts. Results showed that the Pt-Mn/gamma -Al(2)O(3) (3.88 wt.%Mn) at calcination temperature of 300 degrees C was the most promising catalyst based on activity, which might be contributed to the quantity of manganese loading, the favorable synergetic effects between Pt and Mn and the well-dispersed bimetallic phase. An artificial neural networks (ANN) model was developed to predict the performance of catalytic oxidation process over Pt-Mn/gamma -Al(2)O(3) bimetallic catalyst based on experimental data. For this purpose the Levenberg-Marquardt (LM) learning algorithm was employed to train the model by using laboratory experimental data. A comparison between the predicted results of the designed ANN model and experimental data was also conducted. The developed model can describe the catalytic oxidation over bimetallic catalysts under different conditions. PMID:20390890

  8. Concentrations of Mn, Fe, Cu, Zn, Cr, Cd, Pb, Ni in selected Nigerian tubers, legumes and cereals and estimates of the adult daily intakes.

    PubMed

    Akinyele, I O; Shokunbi, O S

    2015-04-15

    This study was designed to determine the levels of microminerals (manganese (Mn), iron (Fe), copper (Cu), zinc (Zn), chromium (Cr)) and heavy metals (cadmium (Cd), lead (Pb) and nickel (Ni)) in some tubers, legumes and cereals obtained from the markets in Abeokuta city, South-West Nigeria. The food samples were digested by dry ashing procedure and their minerals were determined by atomic absorption spectrophotometer. The results show mean values of 1.67-32.00, 7.25-61.58, 1.59-10.56, 6.65-46.99, 0.02-0.58, <0.01-0.09, <0.08, and 0.06-0.14 mg/kg for Mn, Fe, Cu, Zn, Cr, Cd, Pb and Ni respectively. The levels of these metals in all the samples analysed were within the ranges reported for similar tubers, legumes and cereals from various parts of the world. The daily intakes of the metals through tubers, legumes and cereals were found to be lower than the provisional tolerable daily intakes proposed by Joint FAO/WHO Expert Committee on Food Additives.

  9. A first-principles study on the structural, elastic and electronic properties of the C14 Laves phase compounds TiX2 (X=Cr, Mn, Fe)

    NASA Astrophysics Data System (ADS)

    Nong, Zhi-Sheng; Zhu, Jing-Chuan; Cao, Yong; Yang, Xia-Wei; Lai, Zhong-Hong; Liu, Yong

    2013-06-01

    The structural, elastic and electronic properties of nonmagnetic TiCr2, TiMn2 and antiferromagnetic TiFe2 with hexagonal C14 structure were investigated by mean of the first-principles calculations within the frame work of density functional theory (DFT). The calculated lattice constants were in good agreement with the experimental values. The obtained cohesive energy and formation enthalpy showed TiCr2, TiMn2 and TiFe2 are of the structural stability from the energetic point of view. The five independent elastic constants were calculated, showing that these compounds are mechanically stable. Then the polycrystalline elastic parameters (bulk modulus B, shear modulus G, Young's modulus E, and Poisson's ratio ν) were obtained by using the Voigt-Reuss-Hill (V-R-H) approximation, and the ductility and plasticity of these compounds were further analyzed. The elastic anisotropy of these compounds was also discussed in details. Finally, the electronic density of states (DOS) and charge density distribution were also calculated, indicating the existence of a combination of metallic, covalent and ionic bonding in these C14 compounds.

  10. Assessment of heavy metal (Cu, Ni, Fe, Co, Mn, Cr, Zn) pollution in effluent dominated rivulet water and their effect on glycogen metabolism and histology of Mastacembelus armatus.

    PubMed

    Javed, Mehjbeen; Usmani, Nazura

    2013-01-01

    The present study was conducted to examine the contamination of rivulet situated at Kasimpur, Aligarh (27.218° N; 79.378° E). It receives the wastewater of Harduaganj Thermal Power Plant (HTPS) containing fly ash and heavy metals. Among the heavy metals estimated in the rivulet water, Fe (8.71 mgL(-1)) was present in the highest concentration followed by Cu (0.86 mgL(-1)), Zn (0.30 mgL(-1)) Mn (0.21 mgL(-1)), Ni (0.12 mgL(-1)), Co (0.11 mgL(-1)) and Cr (0.10 mgL(-1)). The values for the heavy metals such as Fe, Ni and Mn were beyond the limits set by UNEPGEMS. Bioaccumulation of these heavy metals was detected in tissues such as gills, liver, kidney, muscle and integument of the fish Mastacembelus armatus. Accumulation of Fe (213.29 - 2601.49 mgkg(-1).dw) was highest in all the organs. Liver was the most influenced organ and integument had the least metal load. The accumulation of Fe, Zn, Cu and Mn, observed in the tissues were above the values recommended by FAO/WHO. Biochemical estimation related to blood glucose, liver and muscle glycogen conducted showed significant (p < 0.01) elevation in blood glucose content over control (17.73%), whereas liver glycogen dropped significantly (p < 0.01) over control (-89.83%), and similarly muscle glycogen also decreased significantly (p < 0.05) over control (-71.95%), suggesting enhanced glycolytic capacity to fuel hepatic metabolism. Histopathological alterations were also observed in selected organs (gills, liver and kidney) of Mastacembelus armatus. PMID:24133639

  11. Assessment of heavy metal (Cu, Ni, Fe, Co, Mn, Cr, Zn) pollution in effluent dominated rivulet water and their effect on glycogen metabolism and histology of Mastacembelus armatus.

    PubMed

    Javed, Mehjbeen; Usmani, Nazura

    2013-01-01

    The present study was conducted to examine the contamination of rivulet situated at Kasimpur, Aligarh (27.218° N; 79.378° E). It receives the wastewater of Harduaganj Thermal Power Plant (HTPS) containing fly ash and heavy metals. Among the heavy metals estimated in the rivulet water, Fe (8.71 mgL(-1)) was present in the highest concentration followed by Cu (0.86 mgL(-1)), Zn (0.30 mgL(-1)) Mn (0.21 mgL(-1)), Ni (0.12 mgL(-1)), Co (0.11 mgL(-1)) and Cr (0.10 mgL(-1)). The values for the heavy metals such as Fe, Ni and Mn were beyond the limits set by UNEPGEMS. Bioaccumulation of these heavy metals was detected in tissues such as gills, liver, kidney, muscle and integument of the fish Mastacembelus armatus. Accumulation of Fe (213.29 - 2601.49 mgkg(-1).dw) was highest in all the organs. Liver was the most influenced organ and integument had the least metal load. The accumulation of Fe, Zn, Cu and Mn, observed in the tissues were above the values recommended by FAO/WHO. Biochemical estimation related to blood glucose, liver and muscle glycogen conducted showed significant (p < 0.01) elevation in blood glucose content over control (17.73%), whereas liver glycogen dropped significantly (p < 0.01) over control (-89.83%), and similarly muscle glycogen also decreased significantly (p < 0.05) over control (-71.95%), suggesting enhanced glycolytic capacity to fuel hepatic metabolism. Histopathological alterations were also observed in selected organs (gills, liver and kidney) of Mastacembelus armatus.

  12. Ternary titanium transition metal bismuthides Ti{sub 4}TBi{sub 2} with T = Cr, Mn, Fe, Co, and Ni

    SciTech Connect

    Richter, C.G.; Jeitschko, W.; Kuennen, B.; Gerdes, M.H.

    1997-11-01

    The title compounds were prepared by reaction of the elemental components and with the exception of the isotypic chromium compound their tetragonal V{sub 4}SiSb{sub 2}-type crystal structures (I4/mcm, Z = 4) were determined and refined from single-crystal X-ray data. Ti{sub 4}CrBi{sub 2}: a = 1051.6(l), c = 506.7(1) pm; Ti{sub 4}Mn Bi{sub 2}: a = 1049.1 (1), c = 497.8 (1) pm, R = 0.031 for 176 structure factors; Ti{sub 4}FeBi{sub 2}: a = 1048.6(1), c = 493.3(1) pm, R = 0.013 (274 F values); Ti{sub 4}CoBi{sub 2}: a = 1050.6(2), c = 488.2(1) pm, R = 0.038 (472 F values); Ti{sub 4}NiBi{sub 2}: a = 1055.4(1), c = 481.4(1) pm, R = 0.020(373 F values), and 14 variable parameters each. The compounds are isotypic with V{sub 4}SiSb{sub 2}, a structure which is isopointal with U{sub 6}Mn and closely related to the structures of W{sub 5}Si{sub 3} and TlTe. All atoms have high coordination numbers. Unusual features of the structure are channels formed solely by the bismuth atoms and linear chains of the heavier transition metal ions with bond distances varying between 253.3 (Cr-Cr) and 240.7 pm (Ni-Ni). The electrical conductivities of Ti{sub 4}TBi{sub 2} (T= Fe,Co, Ni)--determined with a four-probe technique for sintered polycrystalline samples between 4 K and room temperature--indicate metallic behavior. The magnetic susceptibilities of the five compounds were determined with a SQUID magnetometer. Ti{sub 4}CrBi{sub 2}, T{sub i}4FeBi{sub 2}, and Ti{sub 4}NiBi{sub 2} are Pauli paramagnetic. The magnetic susceptibilities of Ti{sub 4}MnBi{sub 2} and Ti{sub 4}CoBi{sub 2} are strongly temperature dependent. The evaluation of these data according to a modified Curie-Weiss law suggests that both compounds contain one unpaired electron per formula unit. A brief discussion of chemical bonding in these compounds leads to the conclusion that considerable Ti-Ti bonding must be present in these bismuthides, in spite of the fact that the shortest Ti-Ti bonds are as long as 299 pm.

  13. Investigation of magnetic properties and electronic structure of layered-structure borides AlT{sub 2}B{sub 2} (T=Fe, Mn, Cr) and AlFe{sub 2–x}Mn{sub x}B{sub 2}

    SciTech Connect

    Chai, Ping; Stoian, Sebastian A.; Tan, Xiaoyan; Dube, Paul A.; Shatruk, Michael

    2015-04-15

    The ternary phases AlT{sub 2}B{sub 2} (T=Fe, Mn, Cr) and quaternary phases AlFe{sub 2–x}Mn{sub x}B{sub 2} have been synthesized by arc-melting and characterized by powder X-ray diffraction, magnetic measurements, Mössbauer spectroscopy, and electronic band structure calculations. All the compounds adopt the AlFe{sub 2}B{sub 2}-type structure, in which infinite zigzag chains of B atoms are connected by Fe atoms into [Fe{sub 2}B{sub 2}] slabs that alternate with layers of Al atoms along the b axis. The magnetic measurements reveal that AlFe{sub 2}B{sub 2} is a ferromagnet with T{sub C}=282 K while AlMn{sub 2}B{sub 2} and AlCr{sub 2}B{sub 2} do not show magnetic ordering in the studied temperature range of 1.8–400 K. A systematic investigation of solid solutions AlFe{sub 2−x}Mn{sub x}B{sub 2} showed a non-linear change in the structural and magnetic behavior. The ferromagnetic ordering temperature is gradually decreased as the Mn content (x) increases. The Mössbauer spectra reveal the presence of non-magnetic (NM) and ferromagnetic (FM) spectral components in all Mn-containing samples, with the amount of NM fraction increasing as the Mn content increases. While for the AlFe{sub 2−x}Mn{sub x}B{sub 2} samples with x=0.0 and 0.4 the hyperfine splitting of the FM spectral component collapses at temperatures close to the Curie temperatures determined from the magnetic measurements, for the x=1.2 and 1.6 samples the FM fraction exhibits a sizable unquenched hyperfine splitting at room temperature, a finding that is inconsistent with the observed magnetic properties. Along with the increase in the amount of the NM fraction, this observation suggests formation of Fe-rich and Mn-rich regions in the structure of the solid solutions. Quantum-chemical calculations and crystal orbital Hamilton population analysis provide a clear explanation of the distinction in properties for this series of compounds and also reveal the importance of electronic factors in modifying the

  14. Mn-Cr isotopic systematics of Chainpur chondrules and bulk ordinary chondrites

    NASA Technical Reports Server (NTRS)

    Nyquist, L.; Lindstrom, D.; Wiesmann, H.; Bansal, B.; Shih, C.-Y.; Mittlefehldt, D.; Martinez, R.; Wentworth, S.

    1994-01-01

    We report on ongoing study of the Mn-Cr systematics of individual Chainpur (LL3.4) chondrules and compare the results to those for bulk ordinary chondrites. Twenty-eight chondrules were surveyed for abundances of Mn, Cr, Na, Fe, Sc, Hf, Ir, and Zn by INAA. Twelve were chosen for SEM/EDX and high-precision Cr-isotopic studies on the basis of LL-chondrite-normalized Mn(LL), Sc(LL), (Mn/Fe)(LL), and (Sc/Fe)(LL) as well as their Mn/Cr ratios. Classification into textural types follows from SEM/EDX examination of interior surfaces.

  15. Correlation between saturation magnetization, bandgap, and lattice volume of transition metal (M=Cr, Mn, Fe, Co, or Ni) doped Zn1-xMxO nanoparticles

    NASA Astrophysics Data System (ADS)

    Anghel, J.; Thurber, A.; Tenne, D. A.; Hanna, C. B.; Punnoose, A.

    2010-05-01

    This work reports on transition metal doped ZnO nanoparticles and compares the effects doping with different transition metal ions has on the structural, optical, and magnetic properties. Zn1-xMxO (M=Cr, Mn, Fe, Co, or Ni) nanoparticles were prepared by a chemical process for x=0.02 and 0.05 in powder form. The powders where characterized by x-ray diffraction (XRD), spectrophotometry, and magnetometry. The Zn1-xMxO samples showed a strong correlation between changes in the lattice parameters, bandgap energy, and the ferromagnetic saturation magnetization. Unit cell volume and bandgap, determined from XRD and spectrophotometry respectively, were maximized with Fe doping and decreased as the atomic number of the dopant moved away from Fe. Bandgap was generally lower at x=0.05 than x=0.02 for all dopants. The saturation magnetization reached a maximum of 6.38 memu/g for Zn0.95Fe0.05O.

  16. Microstructural observation of helium implanted and creep ruptured Fe 25%Ni 15%Cr alloys containing various MC and MN formers

    NASA Astrophysics Data System (ADS)

    Yamamoto, Norikazu; Nagakawa, Johsei; Murase, Yoshiharu; Shiraishi, Haruki

    1998-10-01

    Transmission electron microscopic observations have been carried out on Fe-25%Ni-15%Cr austenitic alloys with various MX (M=V, Ti, Nb, Zr; X=C, N) stabilizers after helium implantation and creep rupture at 923 K. It is shown that suppression of helium embrittlement can be achieved through a higher dispersion density of incoherent precipitates because of their high capability of bubble entrapment. A good agreement between the average distance of grain boundary bubbles exceeding the minimum critical size and the spacing of cavity traces on intergranularly fractured surfaces is obtained. This suggests that the enhancement of grain boundary decohesion by helium is a result of unstable growth of super-critical helium bubbles.

  17. Acceleration of ordering transformation of a new Fe{sub 2}(Mn,Cr)Si Heusler-alloy film by very high frequency plasma irradiation process during radio frequency sputter deposition

    SciTech Connect

    Yoshimura, S.; Kobayashi, H.; Egawa, G.; Saito, H.; Ishida, S.

    2011-04-01

    A new Heusler alloy, Fe{sub 2}(Mn,Cr)Si, that is likely to have high spin polarization (P) and high damping constant ({alpha}) was proposed to obtain high magneto-resistance ratio and low spin torque noise in a magnetic read head with a current-perpendicular-to-plane (CPP) giant magneto-resistance (GMR) multilayer. A very high frequency (VHF) plasma irradiation process during radio frequency (RF) sputter deposition was investigated to form the highly ordered structure of the Heusler alloy film with low thermal treatment temperature. The main results are as follows: (1) P and magnetic moment of Fe{sub 2}(Mn{sub 0.5}Cr{sub 0.5})Si with an L2{sub 1} structure were estimated at 0.99 and 2.49 {mu}{sub B}/f.u., respectively, and {alpha} was also estimated to be larger compared with the case of Co{sub 2}MnSi, according to density of states (DOS) calculations. (2) The ordering (at least B2 structure) temperature of Fe{sub 2}(Mn{sub 0.6}Cr{sub 0.4})Si film decreased from 500 to 300 deg. C by using the VHF plasma irradiation process with optimized condition. (3) The surface roughness of Fe{sub 2}(Mn{sub 0.6}Cr{sub 0.4})Si film also reduced from 1.7 to 0.5 nm by using the VHF plasma irradiation process. It is found that the Fe{sub 2}(Mn,Cr)Si Heusler alloy and the VHF plasma irradiation process with optimized condition seems to be applicable for fabrication of high-performance magnetic read head with CPP-GMR device.

  18. Influence of deformation on the structure and the mechanical properties of a high-entropy Fe25Cr20Ni20Co10Mn15Al10 alloy

    NASA Astrophysics Data System (ADS)

    Gorban', B. F.; Nazarenko, V. A.; Danilenko, N. I.; Karpets, M. V.; Krapivka, N. A.; Firstov, S. A.; Makarenko, E. S.

    2014-10-01

    The phase composition, the hardness, and the elasticity modulus of a high-entropy Fe25Cr20Ni20Co10Mn15Al10 alloy have been studied in the as-cast state, after rolling deformation, and after subsequent high-temperature annealing. The alloy consists of the following two phases: solid substitutional solutions with bcc and fcc crystal lattices; in the as-cast state and after annealing the bcc solid solution is ordered according to B2 type (CsCl). The mixture rule is applied for the calculation of the electron density, the atomic radius, and the melting point at grain boundaries and in the grain volume of the alloy after deformation and annealing. The obtained data demonstrate that the alloy is thermally stable.

  19. Free energy landscape approach to aid pure phase synthesis of transition metal (X=Cr, Mn and Fe) doped bismuth titanate (Bi2Ti2O7)

    NASA Astrophysics Data System (ADS)

    Mayfield, Cedric L.; Huda, Muhammad N.

    2016-06-01

    A density functional theory study of Cr, Mn and Fe substitutions in Bi2Ti2O7 (BTO) photocatalysts is presented. We performed a stability analysis from our total energy calculations and have determined formations of dopant inspired phases are detrimental to the overall photocatalytic performance of X-doped BTO. From our calculated formation energies and electronic structures it is shown that X substitution of Ti is least stable and should be associated with formation of secondary phases more so than X substitution of Bi. This result contradicts the many experimental studies which suggest transition metal dopants always substitute Ti in BTO, but on the other hand, explains the poor photocatalytic response beyond what has become known as the critical dopant concentration.

  20. Mn-Cr Dating of Enstatite Chondrites

    NASA Astrophysics Data System (ADS)

    Hopp, J.; Trieloff, M.; Storck, J.-C.; Ludwig, T.; Meyer, H. P.; Altherr, R.; El Goresy, A.

    2016-08-01

    We will present new 53Mn-53Cr age data of enstatite chondrites, analysed with the new Cameca 1280 HR ionprobe facility at Heidelberg University, Germany. Excess 53Cr was detected in several sphalerites, which was the major high Mn/Cr target mineral.

  1. Effect of H2O on metal-silicate partitioning of Ni, Co, V, Cr, Mn and Fe: Implications for the oxidation state of the Earth and Mars

    NASA Astrophysics Data System (ADS)

    Clesi, V.; Bouhifd, M. A.; Bolfan-Casanova, N.; Manthilake, G.; Fabbrizio, A.; Andrault, D.

    2016-11-01

    This study investigates the metal-silicate partitioning of Ni, Co, V, Cr, Mn and Fe during core mantle differentiation of terrestrial planets under hydrous conditions. For this, we equilibrated a molten hydrous CI chondrite model composition with various Fe-rich alloys in the system Fe-C-Ni-Co-Si-S in a multi-anvil over a range of P, T, fO2 and water content (5-20 GPa, 2073-2500 K, from 1 to 5 log units below the iron-wüstite (IW) buffer and for XH2O varying from 500 ppm to 1.5 wt%). By comparing the present experiments with the available data sets on dry systems, we observes that the effect of water on the partition coefficients of moderately siderophile elements is only moderate. For example, for iron we observed a decrease in the partition coefficient of Fe (Dmet/silFe) from 9.5 to 4.3, with increasing water content of the silicate melt, from 0 to 1.44 wt%, respectively. The evolution of metal-silicate partition coefficients of Ni, Co, V, Cr, Mn and Fe are modelled based on sets of empirical parameters. These empirical models are then used to refine the process of core segregation during accretion of Mars and the Earth. It appears that the likely presence of 3.5 wt% water on Mars during the core-mantle segregation could account for ∼74% of the FeO content of the Martian mantle. In contrast, water does not play such an important role for the Earth; only 4-6% of the FeO content of its mantle could be due to the water-induced Fe-oxidation, for a likely initial water concentration of 1.8 wt%. Thus, in order to reproduce the present-day FeO content of 8 wt% in the mantle, the Earth could initially have been accreted from a large fraction (between 85% and 90%) of reducing bodies (similar to EH chondrites), with 10-15% of the Earth's mass likely made of more oxidized components that introduced the major part of water and FeO to the Earth. This high proportion of enstatite chondrites in the original constitution of the Earth is consistent with the 17O,48Ca,50Ti,62Ni

  2. Effect of Cr substitution on the magnetic and magnetic-transport properties of Fe{sub 2}Mn{sub 1-x}Cr{sub x}Si alloys

    SciTech Connect

    Pal, Lakhan; Gupta, Sachin; Suresh, K. G.; Nigam, A. K.

    2014-05-07

    Fe{sub 2}Mn{sub 1-x}Cr{sub x}Si (x = 0, 0.1, and 0.2) alloys were investigated for their magnetic and transport properties in view of the expected half metallicity. It is found that Cr substitution suppresses the antiferromagnetic phase present in parent Fe{sub 2}MnSi, which completely disappears for x = 0.2. Curie temperature of the alloys increases from 230 K to 299 K as x is increased from 0 to 0.2. The value of the Rhodes-Wohlfarth ratio indicates that the system shows iterant magnetism. Resistivity measurements also show absence of antiferromagnetic phase for x = 0.2. Resistivity data have been fitted by considering the electron-phonon and electron-magnon scattering contributions, which indicates the presence of half metallicity in these compounds. Temperature dependence of resistivity data shows magnetoresistance of −3% and −2.5% at Curie temperature with applied field of 50 kOe for x = 0.1 and 0.2, respectively.

  3. Highly (002) textured large grain bcc Cr{sub 80}Mn{sub 20} seed layer on Cr{sub 50}Ti{sub 50} amorphous layer for FePt-C granular film

    SciTech Connect

    Jeon, Seong-Jae Saito, Shin; Hinata, Shintaro; Takahashi, Migaku

    2015-05-07

    Effect of bcc Cr{sub 80}Mn{sub 20} seed layer and Cr{sub 50}Ti{sub 50} amorphous texture inducing layer on the heteroepitaxy system in FePt-C granular film was studied by introducing a new concept of the layered structure. The concept suggested that the large grain seed layer in which the crystallographic texture was initially formed on an amorphous layer in the layered structure can reduce the angular distribution of (002) c-axis crystal orientation in the FePt-C granular film owing to heteroepitaxial growth. Structure analysis by X-ray diffraction revealed that (1) when the substrate heating temperature was elevated from 300 °C to 500 °C, grain size in the seed layer increased from 9.8 nm to 11.6 nm, and then decreased with further increasing the substrate temperature. The reduction of the grain size over 500 °C corresponds to the crystallization of the amorphous texture inducing layer, (2) when the grain size increased from 9.8 nm to 11.6 nm, the angular distribution of the (002) orientation in the seed layer dramatically decreased from 13.7° to 4.1°. It was shown that the large grain seed layer increased the perpendicular hysteresis in FePt-C granular film.

  4. Systematic analysis of structural and magnetic properties of spinel CoB2O4 (B  =  Cr, Mn and Fe) compounds from their electronic structures.

    PubMed

    Das, Debashish; Biswas, Rajkumar; Ghosh, Subhradip

    2016-11-01

    The structural and magnetic properties of spinel compounds CoB2O4 (B  =  Cr, Mn and Fe) are studied using the DFT+U method and generalized gradient approximation. We concentrate on understanding the trends in the properties of these materials as the B cation changes, in terms of relative strengths of crystal fields and exchange fields through an analysis of their electronic densities of states. We find that the electron-electron correlation plays a significant role in obtaining the correct structural and electronic ground states. Significant structural distortion in CoMn2O4 and 'inverted' sublattice occupancy in CoFe2O4 affects the magnetic exchange interactions substantially. The trends in the magnetic exchange interactions are analysed in terms of the structural parameters and the features in their electronic structures. We find that the Fe states in CoFe2O4 are extremely localised, irrespective of the symmetry of the site, which makes it very different from the features of the states of the B cations in two other compounds. These results provide useful insights into the trends in the properties of CoB2O4 compounds with variation of B cation, which would help in understanding the results of recent experiments on doping of Mn and Fe in multiferroic CoCr2O4. PMID:27604305

  5. Systematic analysis of structural and magnetic properties of spinel CoB2O4 (B  =  Cr, Mn and Fe) compounds from their electronic structures

    NASA Astrophysics Data System (ADS)

    Das, Debashish; Biswas, Rajkumar; Ghosh, Subhradip

    2016-11-01

    The structural and magnetic properties of spinel compounds CoB2O4 (B  =  Cr, Mn and Fe) are studied using the DFT+U method and generalized gradient approximation. We concentrate on understanding the trends in the properties of these materials as the B cation changes, in terms of relative strengths of crystal fields and exchange fields through an analysis of their electronic densities of states. We find that the electron-electron correlation plays a significant role in obtaining the correct structural and electronic ground states. Significant structural distortion in CoMn2O4 and ‘inverted’ sublattice occupancy in CoFe2O4 affects the magnetic exchange interactions substantially. The trends in the magnetic exchange interactions are analysed in terms of the structural parameters and the features in their electronic structures. We find that the Fe states in CoFe2O4 are extremely localised, irrespective of the symmetry of the site, which makes it very different from the features of the states of the B cations in two other compounds. These results provide useful insights into the trends in the properties of CoB2O4 compounds with variation of B cation, which would help in understanding the results of recent experiments on doping of Mn and Fe in multiferroic CoCr2O4.

  6. Systematic analysis of structural and magnetic properties of spinel CoB2O4 (B  =  Cr, Mn and Fe) compounds from their electronic structures.

    PubMed

    Das, Debashish; Biswas, Rajkumar; Ghosh, Subhradip

    2016-11-01

    The structural and magnetic properties of spinel compounds CoB2O4 (B  =  Cr, Mn and Fe) are studied using the DFT+U method and generalized gradient approximation. We concentrate on understanding the trends in the properties of these materials as the B cation changes, in terms of relative strengths of crystal fields and exchange fields through an analysis of their electronic densities of states. We find that the electron-electron correlation plays a significant role in obtaining the correct structural and electronic ground states. Significant structural distortion in CoMn2O4 and 'inverted' sublattice occupancy in CoFe2O4 affects the magnetic exchange interactions substantially. The trends in the magnetic exchange interactions are analysed in terms of the structural parameters and the features in their electronic structures. We find that the Fe states in CoFe2O4 are extremely localised, irrespective of the symmetry of the site, which makes it very different from the features of the states of the B cations in two other compounds. These results provide useful insights into the trends in the properties of CoB2O4 compounds with variation of B cation, which would help in understanding the results of recent experiments on doping of Mn and Fe in multiferroic CoCr2O4.

  7. Size effect, critical resolved shear stress, stacking fault energy, and solid solution strengthening in the CrMnFeCoNi high-entropy alloy

    PubMed Central

    Okamoto, Norihiko L.; Fujimoto, Shu; Kambara, Yuki; Kawamura, Marino; Chen, Zhenghao M. T.; Matsunoshita, Hirotaka; Tanaka, Katsushi; Inui, Haruyuki; George, Easo P.

    2016-01-01

    High-entropy alloys (HEAs) comprise a novel class of scientifically and technologically interesting materials. Among these, equatomic CrMnFeCoNi with the face-centered cubic (FCC) structure is noteworthy because its ductility and strength increase with decreasing temperature while maintaining outstanding fracture toughness at cryogenic temperatures. Here we report for the first time by single-crystal micropillar compression that its bulk room temperature critical resolved shear stress (CRSS) is ~33–43 MPa, ~10 times higher than that of pure nickel. CRSS depends on pillar size with an inverse power-law scaling exponent of –0.63 independent of orientation. Planar ½ < 110 > {111} dislocations dissociate into Shockley partials whose separations range from ~3.5–4.5 nm near the screw orientation to ~5–8 nm near the edge, yielding a stacking fault energy of 30 ± 5 mJ/m2. Dislocations are smoothly curved without any preferred line orientation indicating no significant anisotropy in mobilities of edge and screw segments. The shear-modulus-normalized CRSS of the HEA is not exceptionally high compared to those of certain concentrated binary FCC solid solutions. Its rough magnitude calculated using the Fleischer/Labusch models corresponds to that of a hypothetical binary with the elastic constants of our HEA, solute concentrations of 20–50 at.%, and atomic size misfit of ~4%. PMID:27775026

  8. Application of the multireference equation of motion coupled cluster method, including spin-orbit coupling, to the atomic spectra of Cr, Mn, Fe and Co

    NASA Astrophysics Data System (ADS)

    Liu, Zhebing; Huntington, Lee M. J.; Nooijen, Marcel

    2015-10-01

    The recently introduced multireference equation of motion (MR-EOM) approach is combined with a simple treatment of spin-orbit coupling, as implemented in the ORCA program. The resulting multireference equation of motion spin-orbit coupling (MR-EOM-SOC) approach is applied to the first-row transition metal atoms Cr, Mn, Fe and Co, for which experimental data are readily available. Using the MR-EOM-SOC approach, the splittings in each L-S multiplet can be accurately assessed (root mean square (RMS) errors of about 70 cm-1). The RMS errors for J-specific excitation energies range from 414 to 783 cm-1 and are comparable to previously reported J-averaged MR-EOM results using the ACESII program. The MR-EOM approach is highly efficient. A typical MR-EOM calculation of a full spin-orbit spectrum takes about 2 CPU hours on a single processor of a 12-core node, consisting of Intel XEON 2.93 GHz CPUs with 12.3 MB of shared cache memory.

  9. In quest of cathode materials for Ca ion batteries: the CaMO3 perovskites (M = Mo, Cr, Mn, Fe, Co, and Ni).

    PubMed

    Arroyo-de Dompablo, M E; Krich, C; Nava-Avendaño, J; Palacín, M R; Bardé, F

    2016-07-20

    Basic electrochemical characteristics of CaMO3 perovskites (M = Mo, Cr, Mn, Fe, Co, and Ni) as cathode materials for Ca ion batteries are investigated using first principles calculations at the Density Functional Theory level (DFT). Calculations have been performed within the Generalized Gradient Approximation (GGA) and GGA+U methodologies, and considering cubic and orthorhombic perovskite structures for CaxMO3 (x = 0, 0.25, 0.5, 0.75 and 1). The analysis of the calculated voltage-composition profile and volume variations identifies CaMoO3 as the most promising perovskite compound. It combines good electronic conductivity, moderate crystal structure modifications, and activity in the 2-3 V region with several intermediate CaxMoO3 phases. However, we found too large barriers for Ca diffusion (around 2 eV) which are inherent to the perovskite structure. The CaMoO3 perovskite was synthesized, characterized and electrochemically tested, and results confirmed the predicted trends. PMID:27398629

  10. Effect of plasma-catalyst system on NO removal using M–Cu (M = Mn, Ce, Cr, Co, and Fe) catalysts

    NASA Astrophysics Data System (ADS)

    Wang, Tao; Liu, Han-Zi; Yang, Bin; Sun, Bao-Min; Xiao, Hai-Ping; Zhang, Yong-Sheng

    2016-11-01

    A series of M–Cu (M = Mn, Ce, Cr, Co, and Fe) bimetal oxide catalysts combined with plasma were prepared for NO x removal at various temperatures. All catalysts combined with plasma exhibited excellent deNO x activity. The Mn–Cu catalyst showed the highest selective catalytic reduction (SCR) activity; the NO removal efficiency of the Mn–Cu catalyst could reach 90% at a gas temperature of 25 °C. E/N increased as gas temperature increased; the mean electron energy and the proportion of high-energy electrons also increased considerably, producing more active radicals. Without any catalyst, the increase in temperature inhibited NO removal owing to O3 consumption. As the temperature increased, NO removal efficiency decreased below 100 °C however, it increased in the range of 100–300 °C, and then decreased above 300 °C in the plasma-catalyst system. NO2 concentration decreased markedly at 150 °C via the fast SCR reaction.

  11. Microwave-assisted synthesis: A fast and efficient route to produce LaMO{sub 3} (M = Al, Cr, Mn, Fe, Co) perovskite materials

    SciTech Connect

    Prado-Gonjal, J.; Arevalo-Lopez, A.M.; Moran, E.

    2011-02-15

    Research highlights: {yields} Lanthanum perovskites can be prepared by microwave irradiation in a domestic set-up. {yields} Microwave-assisted synthesis yields well crystallized and pure materials, sometimes nanosized. {yields} Rietveld analysis has been performed to refine the structures. {yields} Magnetic and electric measurements are similar to those previously reported. {yields} Microwave-assisted synthesis is a fast and efficient method for the synthesis of lanthanum perovskites. -- Abstract: A series of lanthanum perovskites, LaMO{sub 3} (M = Al, Cr, Mn, Fe, Co), having important technological applications, have been successfully prepared by a very fast, inexpensive, reproducible, environment-friendly method: the microwave irradiation of the corresponding mixtures of nitrates. Worth to note, the microwave source is a domestic microwave oven. In some cases the reaction takes place in a single step, while sometimes further annealings are necessary. For doped materials the method has to be combined with others such as sol-gel. Usually, nanopowders are produced which yield high density pellets after sintering. Rietveld analysis, oxygen stoichiometry, microstructure and magnetic measurements are presented.

  12. Selective solid-phase extraction and analysis of trace-level Cr(III), Fe(III), Pb(II), and Mn(II) Ions in wastewater using diethylenetriamine-functionalized carbon nanotubes dispersed in graphene oxide colloids.

    PubMed

    Zhu, Xiangbing; Cui, Yuemei; Chang, Xijun; Wang, Hua

    2016-01-01

    Multi-walled carbon nanotubes (MCNTs) were dispersed in graphene oxide (GO) colloids to be further functionalized with diethylenetriamine (DETA), resulting in GO-MCNTs-DETA nanocomposites for the solid-phase extraction and analysis of Cr(III), Fe(III), Pb(II), and Mn(II) ions at the trace levels in wastewater. Inductively coupled plasma optical emission spectrometry (ICP-OES) indicates that this new solid-phase sorbent could facilitate the maximum static adsorption capacities of 5.4, 13.8, 6.6 and 9.5 mg g(-1) for Cr(III), Fe(III), Pb(II), and Mn(II) ions, respectively, showing the adsorption capacity up to 95% within about 30 min. Moreover, the detection limits of the GO-MCNTs-DETA-based analysis method were found to be 0.16, 0.50, 0.24 and 0.38 ng mL(-1) for Cr(III), Fe(III), Pb(II), and Mn(II) ions, respectively, with the relative standard deviation of lower than 3.0% (n=5). Importantly, common coexisting ions showed no significant interference on the separation and pre-concentration of these heavy metal ions at pH 4.0. Subsequently, the GO-MCNTs-DETA sorbent was successfully employed for the separation and analysis of trace-level Cr(III), Fe(III), Pb(II), and Mn(II) ions in wastewater samples yielding 75-folds concentration factors. PMID:26695275

  13. PEO-[M(CN)5NO](x-) (M = Fe, Mn, or Cr) interaction as a driving force in the partitioning of the pentacyanonitrosylmetallate anion in ATPS: strong effect of the central atom.

    PubMed

    da Silva, Luis Henrique M; da Silva, Maria C Hespanhol; Francisco, Kelly R; Cardoso, Marcus V C; Minim, Luis A; Coimbra, Jane S R

    2008-09-18

    The partitioning behavior of pentacyanonitrosilmetallate complexes[Fe(CN) 5 NO] (2-), [Mn(CN) 5 NO] 3(-), and [Cr(CN) 5 NO] 3(-)has been studied in aqueous two-phase systems (ATPS) formed by adding poly(ethylene oxide) (PEO; 4000 g mol (-1)) to an aqueous salt solution (Li2 SO4, Na2 SO4, CuSO4, or ZnSO4). The complexes partition coefficients ( K complex) in each of these ATPS have been determined as a function of increasing tie-line length (TLL) and temperature. Unlike the partition behavior of most ions, [Fe(CN) 5 NO] 2(-) and [Mn(CN) 5 NO] 3(-) anions are concentrated in the polymer-rich phase with K values depending on the nature of the central atom as follows: K [Fe(C N) 5 NO] 2 - > K [ Mn (CN 5 NO] 3 - > K [C r (C N) 5 NO ]3 - . The effect of ATPS salts in the complex partitioning behavior has also been verified following the order Li2 SO 4 > Na2 SO 4 > ZnSO4. Thermodynamic analysis revealed that the presence of anions in the polymer-rich phase is caused by an EO-[M(CN) 5 NO] ( x- ) (M = Fe, Mn, or Cr) enthalpic interaction. However, when this enthalpic interaction is weak, as in the case of the [Cr(CN) 5 NO]3(-) anion ( K [Cr(CN 5 NO] 3 - < 1), entropic driving forces dominate the transfer process, then causing the anions to concentrate in the salt-rich phase.

  14. Electron-impact excitation of H-like Cr, Mn, Fe, Co, and Ni for applications in modeling X-ray astrophysical sources

    NASA Astrophysics Data System (ADS)

    Malespin, C.; Ballance, C. P.; Pindzola, M. S.; Witthoeft, M. C.; Kallman, T. R.; Loch, S. D.

    2011-02-01

    Context. Accurate atomic data for the less abundance Fe-peak elements are required for use in X-ray astrophysical studies. Aims: We calculate high quality electron-impact excitation collision strengths and effective collision strengths for hydrogenic Cr, Mn, Fe, Co, and Ni. Methods: We use the Dirac R-matrix method, the intermediate coupling frame transformation R-matrix method, the semi-relativistic distorted-wave method and the fully-relativistic distorted-wave method to calculate collision strengths for each of the ions. The ADAS collisional-radiative codes are used to produce photon emissivity coefficients for each ion. Results: Results are presented for atomic energy levels, spontaneous emission coefficients, electron-impact excitation collision strengths and associated effective collision strengths for each of the five species under consideration. We find relativistic effects can contribute an approximate 10% increase to the background cross section in relation to semi-relativistic collision calculations. We also confirm that radiation damping plays a prominent role for certain near threshold resonances. In order check the integration of our results within collisional-radiative modeling codes, we have used the ADAS package for some preliminary modeling of photon emissivities. The atomic data shall be made available online through the OPEN-ADAS site and the CFADC database Final datasets for each ion are only available in electronic form at CDS via anonymous ftp to cdsarc.u-strasbg.fr (130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/526/A115

  15. Synthesis and characterization of dopamine substitue tripodal trinuclear [(salen/salophen/salpropen)M] (Mdbnd Cr(III), Mn(III), Fe(III) ions) capped s-triazine complexes: Investigation of their thermal and magnetic properties

    NASA Astrophysics Data System (ADS)

    Uysal, Şaban; Koç, Ziya Erdem

    2016-04-01

    In this work, we aimed to synthesize and characterize a novel tridirectional ligand including three catechol groups and its novel tridirectional-trinuclear triazine core complexes. For this purpose, we used melamine (2,4,6-triamino-1,3,5-triazine) (MA) as starting material. 2,4,6-tris(4-carboxybenzimino)-1,3,5-triazine (II) was synthesized by the reaction of an equivalent melamine (I) and three equivalent 4-carboxybenzaldehyde. 4,4‧,4″-((1E,1‧E,1″E)-((1,3,5-triazine-2,4,6-triyl)tris(azanylylidene))tris(methanylylidene))tris(N-(3,4-dihydroxyphenethyl)benzamide) L (IV) was synthesized by the reaction of one equivalent (II) and three equivalent dopamine (3,4-dihydroxyphenethylamine) (DA) by using two different methods. (II, III, IV) and nine novel trinuclear Cr(III), Mn(III) and Fe(III) complexes of (IV) were characterized by means of elemental analyses, 1H NMR, FT-IR spectrometry, LC-MS (ESI+) and thermal analyses. The metal ratios of the prepared complexes were performed using Atomic Absorption Spectrophotometry (AAS). We also synthesized novel tridirectional-trinuclear systems and investigated their effects on magnetic behaviors of [salen, salophen, salpropen Cr(III)/Mn(III)/Fe(III)] capped complexes. The complexes were determined to be low-spin distorted octahedral Mn(III) and Fe(III), and distorted octahedral Cr(III) all bridged by catechol group.

  16. The influences of temperature and microstructure on the tensile properties of a CoCrFeMnNi high-entropy alloy

    SciTech Connect

    Otto, Frederik; Dlouhy, A.; Somsen, Ch.; Bei, Hongbin; Eggeler, G.; George, Easo P

    2013-01-01

    An equiatomic CoCrFeMnNi high-entropy alloy, which crystallizes in the face-centered cubic (FCC) crystal structure, was produced by arc melting and drop casting. The drop-cast ingots were homogenized, cold rolled, and recrystallized to obtain single-phase microstructures with three different grain sizes in the range 4~160 m. Quasi-static tensile tests were then performed at temperatures between 77 and 1073 K. Yield strength, ultimate tensile strength and ductility all increased with decreasing temperature. During the initial stages of plasticity (up to ~2% strain), deformation occurs by planar dislocation glide on the normal FCC slip system {111} 110 at all temperatures and grain sizes investigated. Undissociated 1/2 110 dislocations were observed, as were numerous stacking faults, which imply the dissociation of several of these dislocations into 1/6 112 Shockley partials. At later stages ( 20% strain), nanoscale deformation twins were observed after interrupted tests at 77 K, but not in specimens tested at room temperature where plasticity occurred exclusively by dislocations which organized into cells. Deformation twinning, by continually decreasing the mean free path of dislocations during tensile testing, produces a high degree of work hardening and a significant increase in the ultimate tensile strength. This increased work hardening prevents the early onset of necking instability and is a reason for the enhanced ductility observed at 77 K. A second way in which twinning can contribute to ductility is by providing an additional deformation mode to accommodate plasticity. However, it cannot explain the increase in yield strength with decreasing temperature in our high-entropy alloy since twinning was not observed in the early stages of plastic deformation. Since strong temperature dependencies of yield strength are also seen in binary FCC solid solution alloys, it may be an inherent solute effect, which needs further study.

  17. Photoionization study of Ne-like K9+, Ca10+, Sc11+, Ti12+, V13+, Cr14+, Mn15+, and Fe16+ ions using the screening constant by unit nuclear charge method

    NASA Astrophysics Data System (ADS)

    Goyal, Arun; Khatri, Indu; Sow, Malick; Sakho, Ibrahima; Aggarwal, Sunny; Singh, A. K.; Mohan, Man

    2016-08-01

    Photoionization of the 2s22p6 (1S0) ground state of the Ne-like (Z=19-29) ions is presented in this paper. Resonance energies and total natural width of the 2s2p6np 1P series of the Ne-like K9+, Ca10+, Sc11+, Ti12+, V13+, Cr14+, Mn15+, and Fe16+are reported. All the calculations are made using the Screening constant by unit nuclear charge (SCUNC) formalism. New data for Ne-like K9+, Sc11+, Ti12+, V13+, Cr14+, and Mn15+ions are tabulated. Good agreements are found with available literature data.

  18. Magnetic anisotropy of Fe{sub 1−y}X{sub y}Pt-L1{sub 0} [X = Cr, Mn, Co, Ni, Cu] bulk alloys

    SciTech Connect

    Cuadrado, R.; Chantrell, R. W.; Klemmer, Timothy J.

    2014-10-13

    We demonstrate by means of fully relativistic first principles calculations that, by substitution of Fe by Cr, Mn, Co, Ni, or Cu in FePt-L1{sub 0} bulk alloys, with fixed Pt content, it is possible to tune the magnetocrystalline anisotropy energy by adjusting the content of the non-magnetic species in the material. The changes in the geometry due to the inclusion of each element induces different values of the tetragonality and hence changes in the magnetic anisotropy and in the net magnetic moment. The site resolved magnetic moments of Fe increase with the X content while those of Pt and X are simultaneously reduced. The calculations are in good quantitative agreement with experimental data and demonstrate that models with fixed band structure but varying numbers of electrons per unit cell are insufficient to describe the experimental data for doped FePt-L1{sub 0} alloys.

  19. Solidification structure of C{sub 2.08}Cr{sub 25.43}Si{sub 1.19}Mn{sub 0.43}Fe{sub 70.87} powders fabricated by high pressure gas atomization

    SciTech Connect

    Dai Yongxiang; Yang Min; Song Changjiang; Han, Qingyou; Zhai Qijie

    2010-01-15

    Powders of hypoeutectic high chromium white cast iron (C{sub 2.08}Cr{sub 25.43}Si{sub 1.19}Mn{sub 0.43}Fe{sub 70.87}) were produced by high pressure gas atomization. The microstructure of the powders was characterized using light microscopy, scanning electron microscopy and X-ray diffraction. The results showed that the as-atomized powders were mainly composed of austenite and M{sub 7}C{sub 3} (M = Fe, Cr) type carbide, and became ferrite and carbide after annealing. With the decrease of the powder diameter, the number of austenite grains, primary dendrite length and second dendrite arm spacing were decreased. The relationship between cooling rate and microstructure was also determined.

  20. New series of triple molybdates AgA3R(MoO4)5 (A=Mg, R=Cr, Fe; A=Mn, R=Al, Cr, Fe, Sc, In) with framework structures and mobile silver ion sublattices

    NASA Astrophysics Data System (ADS)

    Kotova, Irina Yu.; Solodovnikov, Sergey F.; Solodovnikova, Zoya A.; Belov, Dmitry A.; Stefanovich, Sergey Yu.; Savina, Aleksandra A.; Khaikina, Elena G.

    2016-06-01

    Triple molybdates AgA3R(MoO4)5 (A=Mg, R=Cr, Fe; A=Mn, R=Al, Cr, Fe, Sc, In) of the NaMg3In(MoO4)5 type were synthesized and single crystals of AgMg3R(MoO4)5 (R=Cr, Fe) were grown. In their structures, the MoO4 tetrahedra, pairs and trimers of edge-shared (Mg, R)O6 octahedra are connected by common vertices to form a 3D framework. Large framework cavities involve Ag+ cations disordered on three nearby positions with CN=3+1 or 4+1. Alternating (Mg, R)O6 octahedra and MoO4 tetrahedra in the framework form quadrangular windows penetrable for Ag+ at elevated temperatures. Above 653-673 K, the newly obtained molybdates demonstrate abrupt reduction of the activation energy to 0.4-0.6 eV. At 773 K, AgMg3Al(MoO4)5 shows electric conductivity 2.5·10-2 S/cm and Ea=0.39 eV compatible with characteristics of the best ionic conductors of the NASICON type.

  1. XANES evidence for oxidation of Cr(III) to Cr(VI) by Mn-oxides in a lateritic regolith developed on serpentinized ultramafic rocks of New Caledonia.

    PubMed

    Fandeur, Dik; Juillot, Farid; Morin, Guillaume; Olivi, Luca; Cognigni, Andrea; Webb, Samuel M; Ambrosi, Jean-Paul; Fritsch, Emmanuel; Guyot, François; Brown, Gordon E

    2009-10-01

    Although several laboratory studies showed that Mn-oxides are capable of oxidizing Cr(II) to Cr(VI), very few have reported evidence for such a reaction in natural systems. This study presents new evidence for this redox reaction between Cr(III) and Mn-oxides in a lateritic regolith developed on ultramafic rocks in New Caledonia. The studied lateritic regolith presents several units with contrasting amounts of major (Fe, Al, Si, and Mg) and trace (Mn, Cr, Ni, Co) elements, which are related to varying mineralogical compositions. Bulk XANES analyses show the occurrence of Cr(VI) (up to 20 wt % of total chromium) in the unit of the regolith which is also enriched in Mn (up to 21.7 wt % MnO), whereas almost no Cr(VI) is detected elsewhere. X-ray powder diffraction indicates that the large amounts of Mn in this unit of the regolith are due to the occurrence of Mn-oxides (identified as a mixture of asbolane, lithiophorite and birnessite) and Mn K-edge XANES data indicate that Mn occurs mainly as Mn(IV) in this unit, although small amounts of Mn(III) could also be detected. These results strongly suggest a direct role of the Mn-oxides on the occurrence of Cr(VI) through a redox reaction between Cr(III) and Mn(IV) and/or Mn(III). Owing to the much larger toxicity and solubility of Cr(VI), such a co-occurrence of Cr and Mn-oxides in these soils could then represent an important risk for the environment. However, the significant amounts of Cr(VI) released after reacting the samples from the studied sequence with a 0.1 M (NH)4H2PO4 solution, designed to remove tightly sorbed chromate species, suggest that Cr(VI) mainly occurs as sorption complexes. This hypothesis is reinforced by spatially resolved XANES analyses, which show that Cr(VI) is associated with both Mn- and Fe-oxides, and especially at the boundary between these two mineral species. Such a distribution of Cr(VI) suggests a possible readsorption of Cr(VI) onto surrounding Fe-oxyhydroxides (mainly goethite) after

  2. Effect of Cr on electronic and magnetic properties of χ-carbide (Fe,Cr)5C2

    NASA Astrophysics Data System (ADS)

    Wang, B.; Zhang, Q.; Zhang, Z. F.; Lv, Z. Q.; Fu, W. T.

    2015-10-01

    From density-function theory calculation, the structural, electronic and magnetic properties of χ-carbides (Fe,Cr)5C2 are investigated. With the increase of Cr content in χ-carbides (Fe,Cr)5C2, the formation energy of χ carbide gradually decrease and energy stability of them increase. The formation energy of Cr5C2 is -0.354 eV/f.u, and the stability of Cr5C2 is higher than other χ carbides (Fe,Cr)5C2, Mn5C2 and Fe5C2. There exists charges transfer from metal cation (Fe/Cr) to C atoms in χ-carbides, and this reveals an ionic contribution to the bonds. The addition of Cr decreases the magnetic moments of χ carbide, and the magnetic moments (Ms) of Cr2Cr2FeC2 and Cr5C2 are 0 μB/f.u., while it expresses opposite magnetic characters of the same atom at different sites in the other χ type (Fe,Cr)5C2 carbides. The 3d states of metal atoms in the majority states (up) move to above the Femi level and some metal atoms (Fe/Cr) in χ type (Fe,Cr)5C2 are undergone the anti-ferromagnetic transformation.

  3. Long-Term Corrosion Testing of Thermal Spray Coatings of Amorphous Metals: Fe49.7Cr17.7Mn1.9Mo7.4W1.6B15.2C3.8Si2.4 and Fe48Mo14Cr15Y2C15B6

    SciTech Connect

    Farmer, J; Day, D; Lian, T; Saw, C; Hailey, P; Payer, J; Aprigliano, L; Beardsley, B; Branagan, D

    2007-07-09

    Amorphous alloys identified as SAM2X5 (Fe{sub 49.7}Cr{sub 17.7}Mn{sub 1.9}Mo{sub 7.4}W{sub 1.6}B{sub 15.2}C{sub 3.8}Si{sub 2.4}) and SAM1651 (Fe{sub 48}Mo{sub 14}Cr{sub 15}Y{sub 2}C{sub 15}B{sub 6}) have been produced as melt-spun ribbons, drop-cast ingots and thermal-spray coatings. Chromium (Cr), molybdenum (Mo) and tungsten (W) additions provided corrosion resistance, while boron (B) enabled glass formation. Earlier electrochemical studies of melt-spun ribbons and ingots of these amorphous alloys demonstrated outstanding passive film stability. More recently thermal-spray coatings of these amorphous alloys have been made and subjected to long-term salt-fog and immersion tests. Good corrosion resistance has been observed during salt-fog testing. Corrosion rates were measured in situ with linear polarization, while simultaneously monitoring the open-circuit corrosion potentials. Reasonably good performance was observed. The sensitivity of these measurements to electrolyte composition and temperature was determined. The high boron content of SAM2X5 also made it an effective neutron absorber, and suitable for criticality control applications.

  4. Spectroscopic and thermal degradation behavior of Cr(III), Mn(II), Fe(III), Co(II), Ni(II), Cu(II) and Zn(II) complexes with thiopental sodium anesthesia drug

    NASA Astrophysics Data System (ADS)

    Refat, Moamen S.

    2013-04-01

    A new series of Cr(III), Mn(II), Fe(III), Co(II), Ni(II), Cu(II) and Zn(II) complexes have been synthesized with thiopental sodium anesthesia drug. The elemental analyses of the complexes are confined to stoichiometry of the formulas [M(TPL)3]ṡnH2O (M = Cr(III) or Fe(III); n = 6 or 5), [M(TPL)2(H2O)2]ṡnH2O (M = Mn(II), Co(II) or Ni(II); n = 0 or 4), and [M(TPL)2] (M = Cu(II) or Zn(II); n = 2 or 0) respectively, where TPL is thiopental chelating agent. Structures have been discussed and suggested upon elemental analyses, infrared, Raman, electronic, electron spin resonance, 1H NMR spectral data and magnetic studies. The X-ray powder diffraction (XRD) was performed of metal complexes. The XRD patterns indicate crystalline nature for the complexes. The measured low molar conductance values in dimethylsulfoxide indicate that the complexes are non-electrolyte nature. Spectroscopic discussion refer that coordination take place through three types: Cdbnd N (pyrimidine moiety) nitrogen and C2sbnd S (2-thiolate group) for Cr(III), Mn(II) and Fe(III), C6dbnd O (amido group) oxygen and C2sbnd S (2-thiolate group) for Co(II) and Ni(II), and Cu(II) and Zn(II) ions coordinated via Cdbnd N (pyrimidine moiety) nitrogen, C2dbnd S (2-thiolate group) and C6dbnd O (amido group) oxygen, respectively. The thermal behavior (TG/DTG/DTA) of the complexes was studied and kinetic parameters were determined by Horowitz-Metzger and Coats-Redfern methods. The thiopental and its complexes have been screened for their antimicrobial (G+ and G-) bacteria (Escherichia coli, Staphylococcus aureus, Bacillus subtilis and Pseudomonas aeruginosa) and fungi (Aspergillus flavus and Candida albicans) activities by minimum inhibitory concentration (MIC) method.

  5. The effect of MC and MN stabilizer additions on the creep rupture properties of helium implanted Fe-25% Ni-15% Cr austenitic alloy

    NASA Astrophysics Data System (ADS)

    Yamamoto, Norikazu; Nagakawa, Johsei; Shiraishi, Haruki

    1995-10-01

    Helium embrittlement resistance of Fe-25% Ni-15% Cr austenitic alloys with various MX (M = V, Ti, Nb, Zr; X = C, N) stabilizers was compared through post helium implantation creep testing at 923 K. While significant deterioration by helium in terms of creep rupture time and elongation occurred for all materials investigated, the suppression of the deterioration, especially in rupture time, was discerned for the materials in which semi-coherent MC (M = Ti, Ti + Nb, V + Ti) particles were distributed at high density. The material which contains the incoherent M 23C 6 as predominant precipitates seems to be less degraded by helium than those containing the MXs (M = Zr, V; X = C, N), if compared at the same number density of precipitates. Therefore, it is suggested that the high density dispersion of incoherent M 23C 6 as well as semi-coherent Ti containing MC particles would be beneficial in reducing the detrimental helium influences on mechanical properties.

  6. Bulk modulus and specific heat of B-site doped (La0.3Pr0.7)0.65Ca0.35Mn1-xBxO3 (B=Fe, Cr, Ru, Al, Ga)

    NASA Astrophysics Data System (ADS)

    Srivastava, Archana; Thakur, Rasna; Gaur, N. K.

    2014-04-01

    Specific heat (Cp) thermal expansion (α) and Bulk modulus (BT) of lightly doped Rare Earth manganites (La0.3Pr0.7)0.65Ca0.35Mn1-xBxO3 (B3+ = Fe3+,Cr3+,Ga3+,Al3+,Ru4+); (0.3Mn0.97Fe0.03O3 as a function of temperature (10K≤T≤ 200K) is found to be in agreement with the published data. The trend of variation of Debye temperature with B-site cationic radius is predicted probably for the first time for the B-site doped rare earth manganites.

  7. Shape memory effect associated with a deformation at a temperature just below A[sub S] in a Fe-Mn-Cr-Si-Ni shape memory alloy

    SciTech Connect

    Federzoni, L.; Guenin, G. )

    1994-07-01

    The shape memory effect of Fe-Mn based shape memory alloys is due to the formation of stress-induced [var epsilon]-martensite by deformation and to its reversion by heating over A[sub f], which permit it to recover a part of the original shape. The shape memory effect is directly associated with the [gamma][yields][var epsilon] transformation. For this reason, the authors have established the best conditions to induce the [var epsilon]-martensite inside an austenitic matrix: the deformation must take place at a temperature close to the M[sub s]. It has been established that a deformation made at a higher temperature degrades the shape memory effect. The purpose of this paper is to evaluate the shape memory effect in the case of a deformation applied at a relatively high temperature (just below A[sub s]) on samples containing a high volume fraction of [var epsilon]-martensite before the deformation. It is shown that an other mechanism of shape memory effect occurs in these conditions and allows to reach an interesting shape memory effect ([approximately]2%).

  8. The effect of the B-site cation and oxygen stoichiometry on the local and average crystal and magnetic structures of Sr2Fe1.9M0.1O5+y (M = Mn, Cr, Co; y = 0, 0.5)

    SciTech Connect

    Ramezanipour, Farshid; Greedan, John; Cranswick, Lachlan M.D.; Garlea, Vasile O; Siewenie, Joan; King, Graham; Llobet, Anna; Donaberger, R. L.

    2012-01-01

    Six compounds with formula Sr2Fe1.9M0.1O5+y (M = Mn, Cr, Co; y = 0, 0.5) were synthesized in air and argon, exhibiting surprisingly different properties depending on the B-cation type in spite of the low (5%) doping level. All argon synthesized phases, y 0, have long range brownmillerite ordering of oxygen vacancies with Icmm symmetry as shown by neutron diffraction (ND). All show long-range G-type antiferromagnetic order with N el temperatures, TN, from variable temperature ND of 649(3)K, 636(2)K and 668(5)K for Cr, Mn and Co-compounds, respectively, compared with Sr2Fe2O5, TN = 693 K. Competing ferromagnetic interactions may be responsible for the anomalously low value in the M = Mn case. The air synthesized phases with y 0.5 show surprising variation with M as investigated by X-ray, TOF and constant wavelength neutron diffractions. The M = Co compound is isostructural with Sr4Fe4O11 (Sr2Fe2O5.5), Cmmm, while the M = Cr phase is cubic, Pm-3m, and that for M = Mn appears to be cubic but the reflections are systematically broadened in a manner which suggests a local Cmmm structure. NPDF studies show that the local structure of the Cr phase is better described in terms of a Cmmm ordering of oxygen vacancies with Fe O coordination numbers of five and six. The M = Co material shows C-type antiferromagnetic long-range magnetic order at 4 K as found for Sr4Fe4O11. TN 230 K is inferred from a ZFC-FC magnetic susceptibility divergence compared with TN = 232 K for un-doped Sr4Fe4O11. The M = Cr and Mn compounds show no long-range magnetic ordering down to 4 K, but the divergence of ZFC and FC susceptibility data indicative of spin glass-like transitions occur at 60 K and 45 K for Cr and Mn, respectively. ND shows both diffuse and sharp Bragg magnetic reflections at positions consistent with a Cmmm cell for the M = Mn phase. For the M = Cr material, a very weak magnetic Bragg peak indexed as (1/2 1/2 1/2), consistent with a G-type AF order, is found at 4 K. These results

  9. An investigation of Cr(VI) removal with metallic iron in the co-presence of sand and/or MnO2.

    PubMed

    Gheju, M; Balcu, I; Vancea, C

    2016-04-01

    This study focused on the influence of sand and/or MnO2 co-presence on the mechanism and kinetics of Cr(VI) removal with Fe(0). The process was investigated under acidic and well-mixed conditions, over the temperature range of 6-32 °C. It was shown that both mechanism and kinetics of the removal process were highly dependent on composition and dose of reactive mixture added to Cr(VI) solution. At 22 °C, indirect chemical reduction with Fe(II) was the main removal path in H2O-Fe(0)-Cr(VI) and H2O-Fe(0)-Sand-Cr(VI) system, while in H2O-Fe(0)-MnO2-Cr(VI) and H2O-Fe(0)-MnO2-Sand-Cr(VI) system removal of Cr(VI) occurred mainly via adsorption on MnO2. The pseudo zero-order kinetic model provided the best match for H2O-Fe(0)-Cr(VI) and H2O-Fe(0)-Sand-Cr(VI) system, while in H2O-Fe(0)-MnO2-Cr(VI) and H2O-Fe(0)-MnO2-Sand-Cr(VI) system the process fitted well to the pseudo second-order model. Temperature influenced the efficiency and kinetics of the process in all investigated systems, and the removal mechanism only in H2O-Fe(0)-MnO2-Cr(VI) and H2O-Fe(0)-MnO2-Sand-Cr(VI) system.

  10. An investigation of Cr(VI) removal with metallic iron in the co-presence of sand and/or MnO2.

    PubMed

    Gheju, M; Balcu, I; Vancea, C

    2016-04-01

    This study focused on the influence of sand and/or MnO2 co-presence on the mechanism and kinetics of Cr(VI) removal with Fe(0). The process was investigated under acidic and well-mixed conditions, over the temperature range of 6-32 °C. It was shown that both mechanism and kinetics of the removal process were highly dependent on composition and dose of reactive mixture added to Cr(VI) solution. At 22 °C, indirect chemical reduction with Fe(II) was the main removal path in H2O-Fe(0)-Cr(VI) and H2O-Fe(0)-Sand-Cr(VI) system, while in H2O-Fe(0)-MnO2-Cr(VI) and H2O-Fe(0)-MnO2-Sand-Cr(VI) system removal of Cr(VI) occurred mainly via adsorption on MnO2. The pseudo zero-order kinetic model provided the best match for H2O-Fe(0)-Cr(VI) and H2O-Fe(0)-Sand-Cr(VI) system, while in H2O-Fe(0)-MnO2-Cr(VI) and H2O-Fe(0)-MnO2-Sand-Cr(VI) system the process fitted well to the pseudo second-order model. Temperature influenced the efficiency and kinetics of the process in all investigated systems, and the removal mechanism only in H2O-Fe(0)-MnO2-Cr(VI) and H2O-Fe(0)-MnO2-Sand-Cr(VI) system. PMID:26826456

  11. Synthesis and Characterization of Cr(III), Mn(III), Fe(III), VO(IV), Zr(IV) and UO2(VI) Complexes of Schiff Base Derived from Isonicotinoyl Hydrazone

    PubMed Central

    Gawande, Pranita U.; Mandlik, P. R.; Aswar, A. S.

    2015-01-01

    2-hydroxy-5-chloro-3-nitroacetophenone isonicotinoyl hydrazone as a Schiff base ligand and its complexes with Cr(III), Mn(III), Fe(III), VO(IV), Zr(IV) and UO2(VI) metal ions have been synthesized. The ligands as well as their metal complexes were well characterized using various physicochemical techniques such as elemental analyses, molar conductance measurements, magnetic measurements, thermal analysis, electronic and IR spectral studies. On the basis of these studies, square pyramidal stereochemistry for Mn(III) and VO(IV) complexes while octahedral stereochemistry for all the other complexes have been suggested. The complexes were found to be stable up to 60-70° and thermal decomposition of the complexes ended with respective metal oxide as a final product. The thermal data have been analyzed for kinetic parameters using Broido and Horowitz-Metzger methods. The synthesized Schiff base ligand and its complexes were also tested for their antimicrobial activity using various microorganisms. PMID:26664052

  12. Spin polarization at Fe/Cr interfaces

    NASA Astrophysics Data System (ADS)

    Pizzagalli, L.; Freyss, M.; Moraitis, G.; Stoeffler, D.; Demangeat, C.; Dreyssé, H.; Vega, A.; Miethaner, S.; Bayreuther, G.

    1997-04-01

    It is shown that contradictory experimental data on magnetic moments and spin order at Fe/Cr interfaces can be explained by structural irregularities at the interfaces. The spin-polarized electronic charge distribution was calculated by using a self-consistent tight-binding model combined with a real-space recursion method. It was used to interpret the total magnetic moment of Cr(001) films and of Cr/Fe(001) sandwiches molecular beam epitaxy grown on Fe(001) from in situ measurements with an alternating gradient magnetometer during film growth. While a strong decrease of the sample moment during Cr deposition was observed on a very smooth surface, no moment change occurred for a strongly faceted surface. The different results of both experiments are consistent with the calculations if we take into account (i) a possible ferrimagnetic c(2×2) spin configuration of a Cr monolayer on Fe(001) which might be favorable in clusters of a certain size and for high step densities; (ii) a possible interchange of one Cr and Fe monolayer at the interface; and (iii) a multidomain configuration with zero net moment of a thin Fe layer on a Cr surface due to a high step density.

  13. Anomalous Hall effect in Cr doped FeSi

    NASA Astrophysics Data System (ADS)

    Yadam, Sankararao; Lakhani, Archana; Singh, Durgesh; Prasad, Rudra; Ganesan, V.

    2016-05-01

    Investigations of economically affordable bulk materials for the spin based electronics are in huge demand. In this direction, electrical and Hall transport properties of the polycrystalline Cr doped Kondo insulator FeSi, i.e Fe0.975Cr0.025Si is reported. Well agreement between temperature dependence of the Hall and linear resistivity are observed. The observed minimum at ~19K in the resistivity is attributed to the ferromagnetic transition temperature (TC). Anomalous Hall resistivity is seen in the itinerant ferromagnet, Fe0.975Cr0.025Si well below the TC. The obtained Hall resistivity is comparable with that of the spintronic material Fe0.9Co0.1Si. The present study proves that the electrical transport properties of bulk materials made by low cost elements such as Fe, Cr and Si exhibits large magnetic field effects and are useful for the spintronics applications, unlike spintronics material (Ga, Mn)As that demand higher costs.

  14. Development of Fe-Mn-Al-X-C alloys

    NASA Technical Reports Server (NTRS)

    Schuon, S. R.

    1982-01-01

    Development of a low cost Cr-free, iron-base alloy for aerospace applications involves both element substitution and enhancement of microstructural strengthening. When Mn is substituted for Ni and Al or Si is substituted for Cr, large changes occur in the mechanical and thermal stability of austenite in FeMnAlC alloys. The in situ strength of MC or M2C (M = Ti, V, Hf, Ta, or Mo) in FeMnAlC alloys was determined. The high temperature tensile strength depends more on the distribution of carbides than the carbide composition. Precipitation of a high volume percent-ordered phase was achieved in Fe2OMnlONi6Al6Ti (lC) alloys. As case, these alloys have a homogeneous austenitic structure. After solutioning at 1100 C for 5 hr followed by aging at 600 C for 16 hr, gamma prime or a perovskite carbide is precipitated. Overaging occurs at 900 C where eta is precipitated.

  15. The influence of cooling rate and Fe/Cr content on the evolution of Fe-rich compounds in a secondary Al-Si-Cu diecasting alloy

    NASA Astrophysics Data System (ADS)

    Fabrizi, A.; Timelli, G.

    2016-03-01

    This study investigates the morphological evolution of primary α-Al(Fe,Mn,Cr)Si phase in a secondary Al-Si-Cu alloy with respect to the initial Fe and Cr contents as well as to the cooling rate. The solidification experiments have been designed in order to cover a wide range of cooling rates, and the Fe and Cr contents have been varied over two levels. Metallographic and image analysis techniques have been used to quantitatively examine the microstructural changes occurring at different experimental conditions. The morphological evolution of the α-Fe phase has been also analysed by observing deep etched samples. By changing the cooling rate, α-Al15(Fe,Mn,Cr)3Si2 dodecahedron crystals, as well as Chinese- script, branched structures and dendrites form, while primary coarse β-Al5(Fe,Mn)Si needles appear in the alloy with the highest Fe content at low cooling rates.

  16. A Study of Different Doped Metal Cations on the Physicochemical Properties and Catalytic Activities of Ce20 M1 Ox (M=Zr, Cr, Mn, Fe, Co, Sn) Composite Oxides for Nitric Oxide Reduction by Carbon Monoxide.

    PubMed

    Deng, Changshun; Li, Min; Qian, Junning; Hu, Qun; Huang, Meina; Lin, Qingjin; Ruan, Yongshun; Dong, Lihui; Li, Bin; Fan, Minguang

    2016-08-01

    This work is mainly focused on investigating the effects of different doped metal cations on the formation of Ce20 M1 Ox (M=Zr, Cr, Mn, Fe, Co, Sn) composite oxides and their physicochemical and catalytic properties for NO reduction by CO as a model reaction. The obtained samples were characterized by using N2 physisorption, X-ray diffraction, laser Raman spectroscopy, UV/Vis diffuse reflectance spectroscopy, inductively coupled plasma atomic emission spectroscopy, X-ray photoelectron spectroscopy, temperature-programmed reduction by hydrogen and by oxygen (H2 -TPR and O2 -TPD), in situ diffuse reflectance infrared Fourier transform spectroscopy, and the NO+CO model reaction. The results imply that the introduction of M(x+) into the lattice of CeO2 increases the specific surface area and pore volume, especially for variable valence metal cations, and enhances the catalytic performance to a great extent. In this regard, increases in the oxygen vacancies, reduction properties, and chemisorbed O2 (-) (and/or O(-) ) species of these Ce20 M1 Ox composite oxides (M refers to variable valence metals) play significant roles in this reaction. Among the samples, Ce20 Cr1 Ox exhibited the best catalytic performance, mainly because it has the best reducibility and more chemisorbed oxygen, and significant reasons for these attributes may be closely related to favorable synergistic interactions of the vacancies and near-surface Ce(3+) and Cr(3+) . Finally, a possible reaction mechanism was tentatively proposed to understand the reactions.

  17. A Study of Different Doped Metal Cations on the Physicochemical Properties and Catalytic Activities of Ce20 M1 Ox (M=Zr, Cr, Mn, Fe, Co, Sn) Composite Oxides for Nitric Oxide Reduction by Carbon Monoxide.

    PubMed

    Deng, Changshun; Li, Min; Qian, Junning; Hu, Qun; Huang, Meina; Lin, Qingjin; Ruan, Yongshun; Dong, Lihui; Li, Bin; Fan, Minguang

    2016-08-01

    This work is mainly focused on investigating the effects of different doped metal cations on the formation of Ce20 M1 Ox (M=Zr, Cr, Mn, Fe, Co, Sn) composite oxides and their physicochemical and catalytic properties for NO reduction by CO as a model reaction. The obtained samples were characterized by using N2 physisorption, X-ray diffraction, laser Raman spectroscopy, UV/Vis diffuse reflectance spectroscopy, inductively coupled plasma atomic emission spectroscopy, X-ray photoelectron spectroscopy, temperature-programmed reduction by hydrogen and by oxygen (H2 -TPR and O2 -TPD), in situ diffuse reflectance infrared Fourier transform spectroscopy, and the NO+CO model reaction. The results imply that the introduction of M(x+) into the lattice of CeO2 increases the specific surface area and pore volume, especially for variable valence metal cations, and enhances the catalytic performance to a great extent. In this regard, increases in the oxygen vacancies, reduction properties, and chemisorbed O2 (-) (and/or O(-) ) species of these Ce20 M1 Ox composite oxides (M refers to variable valence metals) play significant roles in this reaction. Among the samples, Ce20 Cr1 Ox exhibited the best catalytic performance, mainly because it has the best reducibility and more chemisorbed oxygen, and significant reasons for these attributes may be closely related to favorable synergistic interactions of the vacancies and near-surface Ce(3+) and Cr(3+) . Finally, a possible reaction mechanism was tentatively proposed to understand the reactions. PMID:27435470

  18. Influence of the type of tree habitat on the character of co-occurrence of Fe, Mn, Zn, Cu, Pb, Ni, Cr and Co in the soil of the Tatra Mountain National Park.

    PubMed

    Kwapuliński, Jerzy; Paprotny, Łukasz; Paukszto, Andrzej; Kowol, Jolanta; Rochel, Robert; Nogaj, Ewa; Musielińska, Renata; Celiński, Rafał

    2013-01-01

    The objective of the research was to determine the effect of habitat type of selected species of trees on the nature of co-occurrence of Fe, Mn, Zn, Cu, Pb, Cd, Ni, Cr and Co. The presence of speciation forms of these metals was investigated, with reference to the species composition of tree stands in selected areas of the Tatra Mountain National Park (Chochołowska Valley, Strążyska Valley, Kościeliska Valley, as well as Mała Łąka Valley).Contents of selected metals in samples were determined by the flame ASA method, with an accuracy of 0.1 µg/g. In habitats dominated by maples, the Pb content in the Chochołowska Valley, unlike Kościeliska Valley covered with beeches, the Pb content in the form directly bioavailable, was twice as high. This was clearly proved in the case of Strążyska Valley where the soil in beech tree habitats contained larger quantities of exchangeable forms of Pb, than that in the Chochołowska Valley. The soil of the valleys, including the Mała Łąka Valley, showed peculiar characteristic averaging of the contents of selected speciation forms of metals in the soil. Content corresponding to 10 percentile and geometrical average may be regarded as benchmarks in future studies of the Tatra Mountain National Park, or other protected areas. PMID:24069853

  19. High-valent [MnFe] and [FeFe] cofactors in ribonucleotide reductases.

    PubMed

    Leidel, Nils; Popović-Bijelić, Ana; Havelius, Kajsa G V; Chernev, Petko; Voevodskaya, Nina; Gräslund, Astrid; Haumann, Michael

    2012-03-01

    Ribonucleotide reductases (RNRs) are essential for DNA synthesis in most organisms. In class-Ic RNR from Chlamydia trachomatis (Ct), a MnFe cofactor in subunit R2 forms the site required for enzyme activity, instead of an FeFe cofactor plus a redox-active tyrosine in class-Ia RNRs, for example in mouse (Mus musculus, Mm). For R2 proteins from Ct and Mm, either grown in the presence of, or reconstituted with Mn and Fe ions, structural and electronic properties of higher valence MnFe and FeFe sites were determined by X-ray absorption spectroscopy and complementary techniques, in combination with bond-valence-sum and density functional theory calculations. At least ten different cofactor species could be tentatively distinguished. In Ct R2, two different Mn(IV)Fe(III) site configurations were assigned either L(4)Mn(IV)(μO)(2)Fe(III)L(4) (metal-metal distance of ~2.75Å, L = ligand) prevailing in metal-grown R2, or L(4)Mn(IV)(μO)(μOH)Fe(III)L(4) (~2.90Å) dominating in metal-reconstituted R2. Specific spectroscopic features were attributed to an Fe(IV)Fe(III) site (~2.55Å) with a L(4)Fe(IV)(μO)(2)Fe(III)L(3) core structure. Several Mn,Fe(III)Fe(III) (~2.9-3.1Å) and Mn,Fe(III)Fe(II) species (~3.3-3.4Å) likely showed 5-coordinated Mn(III) or Fe(III). Rapid X-ray photoreduction of iron and shorter metal-metal distances in the high-valent states suggested radiation-induced modifications in most crystal structures of R2. The actual configuration of the MnFe and FeFe cofactors seems to depend on assembly sequences, bound metal type, valence state, and previous catalytic activity involving subunit R1. In Ct R2, the protonation of a bridging oxide in the Mn(IV)(μO)(μOH)Fe(III) core may be important for preventing premature site reduction and initiation of the radical chemistry in R1. PMID:22222354

  20. Mn-Cr isotopic systematics of individual Chainpur chondrules. [Abstract only

    NASA Technical Reports Server (NTRS)

    Nyquist, L.; Lindstrom, D.; Wiesmann, H.; Martinez, R.; Bansal, B.; Mittlefehldt, D.; Shih, C.-Y.; Wentworth, S.

    1994-01-01

    Twenty-eight chondrules separated from Chainpur (LL3.4) were surveyed for abundances of Mn, Cr, Na, Fe, Sc, Hf, Ir, and Zn by Instrumental Neutron Activation Analysis (INAA). Six, weighting 0.6-1.5 mg each, were chosen for Scanning Electron Microscopy (SEM)/Energy Dispersive X-ray (EDX) and high-precision Ce-isotopic studies. LL-chondrite-normalized (Mn/Fe)(sub LL) and (Sc/Fe)(sub LL) were found to be useful in categorizing them. Five chondrules (CH-16, -17, -18, -23, and -28) were in the range 0.5 less than (Mn/Fe)(sub LL) less than 1. 4 and 0.5 less than (Sc/Fe)(sub LL) less than 1.4. The sixth (CH-25) had (Mn/Fe)(sub LL) and (Sc/Fe)(sub LL) ratios of 0.40 and 8.1, respectively, and was enriched in the refractory lithophile elements Sc and Hf and the refractory siderophile element Ir by 2.7 and 4.4x LL abundances respectively. SEM/EDX of exterior surfaces of the chondrules showed they consisted of varying proportions of low- and high-Ca pyroxenes, olivine, glass, kamacite/taenite, and Fe-sulfides. Chromium-53/chromium-52 for the six chondrules and bulk Chainpur (WR) are presented. Chromium-54/chromium-52 is close to terrestrial and does not correlate with Mn/Cr. We provisionally ignore the possibility of initial Cr isotopic heterogeneities among the chondrules. Omitting both the CH-25 and WR data, a linear regression gives initial (Mn-53/Mn-55)(sub I) = 8 +/- 4 x 10(exp -6), corresponding to chondrule formation at Delta(t)(sub LEW) = -9 +/- 4 Ma prior to igneous crystallization of the LEW 86010 angrite. If initial (Mn-53/Mn-55)(sub 0) in the solar system were as high as approximately 4.4 x 10(exp -5) when Allende CAI formed, our data suggest Chainpur chondrules formed approximately 9 Ma later, in qualitative agreement with 'late' I-Xe formation ages for most Chainpur chondrules.

  1. Structural characterization of Cr/Gd/Cr and Cr/Gd/Fe/Cr multilayer nanostructures by X-ray reflectometry

    NASA Astrophysics Data System (ADS)

    Babanov, Yu. A.; Salamatov, Yu. A.; Ponomarev, D. A.; Naumova, L. I.; Proglyado, V. V.; Milyaev, M. A.; Ustinov, V. V.

    2015-11-01

    It is shown that the new approach to low-contrast systems upon the interpretation of X-ray reflectivity data can be applied to multilayer samples such as Cr/Gd/Fe/Cr/Si. The method is based on solving the Fredholm integral equation of the first kind, which connects the reflectivity with the concentration profiles of elements that enter into the sample composition. The inverse ill-posed problem of the determination of the concentration profile is solved using the regularization method. The efficiency of the method proposed is verified by model calculations fulfilled for a Cr/Gd/Fe/Cr/Si four-layer structure, where there are both high-contrast pairs of layers (Cr/Gd) and pairs with a low contrast (Fe/Cr). Experimental data for Cr/Gd/Cr and Cr/Gd/Fe/Cr multilayer nanoheterostructures have been obtained under laboratory conditions. The thicknesses of all layers of all the elements and of the Cr/Gd, Gd/Fe, and Fe/Cr interfaces have been determined.

  2. X-ray photoelectron spectroscopic analysis of oxidized Fe-16Cr-16Ni-2Mn-1Mo-2Si austenitic stainless steel

    SciTech Connect

    Poston, J.A., Jr.; Siriwardane, R.V.; Dunning, J.S.; Alman, D.E.; Rawers, J.C.

    2007-03-30

    Depth profile analysis (argon ion etching/X-ray photoelectron spectroscopy) was conducted on a series of Fe–16Cr–16Ni–2Mn–1Mo–2Si austenitic stainless steel samples oxidized at 973 and 1073 K with exposure times of 25, 100, 193, 436 and 700 h. Surface and near surface rearrangement following oxidation resulted in a region of high Cr concentration on all oxidized samples. Temperature and time dependence to O2 penetration depth was observed. In general, O2 penetration depth was found to increase with increasing exposure up to 436 h. No increase in depth was observed between 436 and 700 h exposure time.

  3. Influence of Bulk Chemical Composition on Relative Sensitivity Factors for 55Mn/52Cr by SIMS: Implications for the 53Mn-53Cr Chronometer

    SciTech Connect

    Matzel, J; Jacobsen, B; Hutcheon, I D; Kita, N; Ryerson, F J

    2009-09-09

    The {sup 53}Mn-{sup 53}Cr systematics of meteorite samples provide an important high resolution chronometer for early solar system events. Accurate determination of the initial abundance of {sup 53}Mn ({tau}{sub 1/2} = 3.7 Ma) by secondary ion mass spectrometry (SIMS) is dependent on properly correcting for differing ion yields between Mn and Cr by use of a relative sensitivity factor (RSF). Ideal standards for SIMS analysis should be compositionally and structurally similar to the sample of interest. However, previously published Mn-Cr studies rely on few standards (e.g., San Carlos olivine, NIST 610 glass) despite significant variations in chemical composition. We investigate a potential correlation between RSF and bulk chemical composition by determining RSFs for {sup 55}Mn/{sup 52}Cr in 11 silicate glass and mineral standards (San Carlos olivine, Mainz glasses KL2-G, ML3B-G, StHs6/80-G, GOR128-G, BM90/21-G, and T1-G, NIST 610 glass, and three LLNL pyroxene-composition glasses). All standards were measured on the Cameca ims-3f ion microprobe at LLNL, and a subset were also measured on the Cameca ims-1270 ion microprobe at the Geological Survey of Japan. The standards cover a range of bulk chemical compositions with SiO{sub 2} contents of 40-71 wt.%, FeO contents of 0.05-20 wt.% and Mn/Cr ratios between 0.4 and 58. We obtained RSF values ranging from 0.83 to 1.15. The data obtained on the ims-1270 ion microprobe are within {approx}10% of the RSF values obtained on the ims-3f ion microprobe, and the RSF determined for San Carlos olivine (0.86) is in good agreement with previously published data. The typical approach to calculating an RSF from multiple standard measurements involves making a linear fit to measured {sup 55}Mn/{sup 52}Cr versus true {sup 55}Mn/{sup 52}Cr. This approach may be satisfactory for materials of similar composition, but fails when compositions vary significantly. This is best illustrated by the {approx}30% change in RSF we see between

  4. Evaluation of hardening behaviors in ion-irradiated Fe-9Cr and Fe-20Cr alloys by nanoindentation technique

    NASA Astrophysics Data System (ADS)

    Li, Shilei; Wang, Yanli; Dai, Xianyuan; Liu, Fang; Li, Jinyu; Wang, Xitao

    2016-09-01

    The ion irradiation hardening behaviors of Fe-9 wt% Cr and Fe-20 wt% Cr model alloys were investigated by nanoindentation technique. The specimens were irradiated with 3 MeV Fe11+ ions at room temperature up to 1 and 5 dpa for Fe-9Cr alloy and 1 and 2.5 for Fe-20Cr alloy. The ratio of average hardness in the same depth of irradiated and unirradiated (Hirr. av/Hunirr. av) was used to determine the critical indentation depth hcrit to eliminate the softer substrate effect. The Nix-Gao model was used to explain the indentation size effect. Irradiation hardening is clearly observed in both Fe-9Cr alloy and Fe-20Cr alloy after ion irradiation. The differences of ISE and irradiation hardening behaviors between Fe-9Cr and Fe-20Cr alloys are considered to be due to their different microstructures and microstructural evolution under ion irradiation.

  5. The effect of interstitial carbon on the mechanical properties and dislocation substructure evolution in Fe40.4Ni11.3Mn34.8Al7.5Cr6 high entropy alloys

    DOE PAGESBeta

    Wang, Zhangwei; Baker, Ian; Cai, Zhonghou; Chen, Si; Poplawsky, Jonathan D.; Guo, Wei

    2016-09-01

    A systematic study of the effects of up to 1.1 at. % carbon on the mechanical properties and evolution of the dislocation substructure in a series of a high entropy alloys (HEA) based on Fe40.4Ni11.3Mn34.8Al7.5Cr6 is presented. Transmission electron microscopy (TEM), synchrotron X-ray diffraction (XRD) and atom probe tomography (APT) were used to show that all the alloys are single-phase f.c.c. random solid solutions. The lattice constant, determined from synchrotron XRD measurements, increases linearly with increasing carbon concentration, which leads to a linear relationship between the yield strength and the carbon concentration. The dislocation substructures, as determined by a TEM,more » show a transition from wavy slip to planar slip and, at higher strains, and from cell-forming structure (dislocations cells, cell blocks and dense dislocation walls) to non-cell forming structure (Taylor lattice, microbands and domain boundaries) with the addition of carbon, features related to the increase in lattice friction stress. The stacking fault energy (measured via weak-beam imaging of the separation of dislocation partials) decreases with increasing carbon content, which also contributes to the transition from wavy slip to planar slip. The formation of non-cell forming structure induced by carbon leads to a high degree of strain hardening and a substantial increase in the ultimate tensile strength. In conclusion, the consequent postponement of necking due to the high strain hardening, along with the plasticity accommodation arising from the formation of microbands and domain boundaries, result in an increase of ductility due to the carbon addition.« less

  6. Interstitial loop transformations in FeCr

    SciTech Connect

    Béland, Laurent Karim; Osetsky, Yuri N.; Stoller, Roger E.; Xu, Haixuan

    2015-03-27

    Here, we improve the Self-Evolving Atomistic Kinetic Monte Carlo (SEAKMC) algorithm by integrating the Activation Relaxation Technique nouveau (ARTn), a powerful open-ended saddle-point search method, into the algorithm. We use it to investigate the reaction of 37-interstitial 1/2[1 1 1] and 1/2[View the MathML source] loops in FeCr at 10 at.% Cr. They transform into 1/2[1 1 1], 1/2[View the MathML source], [1 0 0] and [0 1 0] 74-interstitial clusters with an overall barrier of 0.85 eV. We find that Cr decoration locally inhibits the rotation of crowdions, which dictates the final loop orientation. Moreover, the final loop orientation depends on the details of the Cr decoration. Generally, a region of a given orientation is favored if Cr near its interface with a region of another orientation is able to inhibit reorientation at this interface more than the Cr present at the other interfaces. Also, we find that substitutional Cr atoms can diffuse from energetically unfavorable to energetically favorable sites within the interlocked 37-interstitial loops conformation with barriers of less than 0.35 eV.

  7. Interstitial loop transformations in FeCr

    DOE PAGESBeta

    Béland, Laurent Karim; Osetsky, Yuri N.; Stoller, Roger E.; Xu, Haixuan

    2015-03-27

    Here, we improve the Self-Evolving Atomistic Kinetic Monte Carlo (SEAKMC) algorithm by integrating the Activation Relaxation Technique nouveau (ARTn), a powerful open-ended saddle-point search method, into the algorithm. We use it to investigate the reaction of 37-interstitial 1/2[1 1 1] and 1/2[View the MathML source] loops in FeCr at 10 at.% Cr. They transform into 1/2[1 1 1], 1/2[View the MathML source], [1 0 0] and [0 1 0] 74-interstitial clusters with an overall barrier of 0.85 eV. We find that Cr decoration locally inhibits the rotation of crowdions, which dictates the final loop orientation. Moreover, the final loop orientationmore » depends on the details of the Cr decoration. Generally, a region of a given orientation is favored if Cr near its interface with a region of another orientation is able to inhibit reorientation at this interface more than the Cr present at the other interfaces. Also, we find that substitutional Cr atoms can diffuse from energetically unfavorable to energetically favorable sites within the interlocked 37-interstitial loops conformation with barriers of less than 0.35 eV.« less

  8. Exploring the Cr2+ doping effect on structural, vibrational and dielectric properties of Mn-Zn ferrites

    NASA Astrophysics Data System (ADS)

    Choudhary, Pankaj; Tyagi, Tarun; Dar, M. A.; Varshney, Dinesh

    2016-05-01

    A series of Cr doped Mn-Zn ferrites with compositional formula Mn0.5Zn0.5-xCrxFe2O4 (x = 0, 0.3, 0.5) were prepared by solid-state reaction route. X-ray diffraction (XRD) analysis reveals that the samples prepared are polycrystalline cubic spinel in structure (Fd3m) with some secondary phase of α-Fe2O3. Slight variation in the lattice parameter of Cr doped Mn0.5Zn0.5Fe2O4 has been observed due to difference in ionic radii of cations. Small shift in Raman modes towards higher wave number has been observed. Further the line width decreases with the doping ions. A giant dielectric constant ~104 is observed for parent Mn0.5Zn0.5Fe2O4 which is found to decrease with increase in Cr2+ doping. Low dielectric loss is observed for Mn0.5Zn0.5Fe2O4 and improves with Cr2+ doping at Zn2+ site.

  9. Noncollinear magnetism of Mn nanowires on Fe(1 1 0).

    PubMed

    Igarashi, R N; Miranda, I P; Eleno, L T F; Klautau, A B; Petrilli, H M

    2016-08-17

    Magnetic properties of Mn linear nanochains on a bcc Fe(1 1 0) surface have been studied using the first-principles real space-linear muffin-tin orbital atomic sphere approximation (RS-LMTO-ASA) method. We have considered up to nine Mn atoms deposited on bcc Fe(1 1 0). Our ab initio calculations reveal the competition between the antiferromagnetic Mn-Mn and Mn-Fe couplings, presenting a behavior which is very different from Mn nanowires on Fe(0 0 1), as shown in a previous publication. Due to this competition and non-negligible Dzyaloshinskii-Moriya interaction, noncollinear magnetic structures are stabilized as ground states for the Mn nanochains on Fe(1 1 0). PMID:27346457

  10. Noncollinear magnetism of Mn nanowires on Fe(1 1 0).

    PubMed

    Igarashi, R N; Miranda, I P; Eleno, L T F; Klautau, A B; Petrilli, H M

    2016-08-17

    Magnetic properties of Mn linear nanochains on a bcc Fe(1 1 0) surface have been studied using the first-principles real space-linear muffin-tin orbital atomic sphere approximation (RS-LMTO-ASA) method. We have considered up to nine Mn atoms deposited on bcc Fe(1 1 0). Our ab initio calculations reveal the competition between the antiferromagnetic Mn-Mn and Mn-Fe couplings, presenting a behavior which is very different from Mn nanowires on Fe(0 0 1), as shown in a previous publication. Due to this competition and non-negligible Dzyaloshinskii-Moriya interaction, noncollinear magnetic structures are stabilized as ground states for the Mn nanochains on Fe(1 1 0).

  11. Noncollinear magnetism of Mn nanowires on Fe(1 1 0)

    NASA Astrophysics Data System (ADS)

    Igarashi, R. N.; Miranda, I. P.; Eleno, L. T. F.; Klautau, A. B.; Petrilli, H. M.

    2016-08-01

    Magnetic properties of Mn linear nanochains on a bcc Fe(1 1 0) surface have been studied using the first-principles real space-linear muffin-tin orbital atomic sphere approximation (RS-LMTO-ASA) method. We have considered up to nine Mn atoms deposited on bcc Fe(1 1 0). Our ab initio calculations reveal the competition between the antiferromagnetic Mn-Mn and Mn-Fe couplings, presenting a behavior which is very different from Mn nanowires on Fe(0 0 1), as shown in a previous publication. Due to this competition and non-negligible Dzyaloshinskii-Moriya interaction, noncollinear magnetic structures are stabilized as ground states for the Mn nanochains on Fe(1 1 0).

  12. Low hysteresis FeMn-based top spin valve.

    PubMed

    Ustinov, V V; Krinitsina, T P; Milyaev, M A; Naumova, L I; Proglyado, V V

    2012-09-01

    FeMn-based top spin valves Ta/[FeNi/CoFe]/Cu/CoFe/FeMn/Ta with different Cu and FeMn layers thicknesses were prepared by DC magnetron sputtering at room temperature. It was shown that low field hysteresis due to free layer magnetization reversal can be reduced down to (0.1 divided by 0.2) Oe keeping the GMR ratio higher 8% by using both layers thicknesses optimization and non-collinear geometry of magnetoresistance measurements. Dependence of low field hysteresis and GMR ratio on the angle between applied magnetic field and pinning direction are presented. PMID:23035516

  13. Diffusion kinetics of Cr in spinel: Experimental studies and implications for 53Mn-53Cr cosmochronology

    NASA Astrophysics Data System (ADS)

    Posner, Esther S.; Ganguly, Jibamitra; Hervig, Richard

    2016-02-01

    The 53Mn-53Cr decay system, in which 53Mn decays to 53Cr (t1/2 = 3.7 Ma) has been widely used to construct 53Cr/52Cr vs. 55Mn/52Cr isochrons and thus determine relative ages of early solar system objects or events, assuming that the initial Cr isotopic ratio, (53Cr/52Cr)o, equals (53Mn/52Cr)o. With the primary objective of interpretation of these ages within a diffusion kinetic framework, we have determined the tracer diffusion coefficient of Cr in natural spinels, which are very close to the MgAl2O4 end-member composition, as a function of temperature and oxygen fugacity (f(O2)). It is found that the diffusion coefficient of Cr, D(Cr), in two stocks of spinels (referred to as cut-gems and gem-gravels) with very similar major element chemistry is consistently different, but the data in each stock yield well defined Arrhenius relations that show a difference of log D of 0.6-1.0, depending on temperature, with the D(Cr) in gem-gravel being higher than that in the cut-gem stock. The D(Cr) was found to have a positive dependence on f(O2) in the range of f(O2) of around ±2 log units relative to that of the wüstite-magnetite buffer. The difference in the D(Cr) between the two stocks and the observed D(Cr) vs. f(O2) relation has been explained in terms of a change of point defect concentration resulting from heterovalent substitution of trace elements and equilibration with the imposed f(O2) conditions, respectively. Assuming a homogeneous semi-infinite matrix, the closure temperature (Tc) of Cr diffusion in spinel has been calculated as a function of grain size, cooling rate, peak temperature (To) and f(O2). Also the dependence of D(Cr) and Tc(Cr) on the Cr# (i.e. Cr/(Cr + Al) ratio) has been accounted for using available D(Cr) vs. Cr# data in Suzuki et al. (2008). We argue, on the basis of crystal chemical considerations and available diffusion kinetic data for minerals, that the Tc for Mn should be much lower than that for Cr in spinel, olivine and orthopyroxene, and

  14. Corrosion Behavior of 35CrMn and Q235 Steel in Simulated Acid Rain Conditions

    NASA Astrophysics Data System (ADS)

    Zuo, Xiu-li; Xiang, Bin; Li, Xing; Wei, Zi-dong

    2012-04-01

    Effects of pH value, chloride ion concentration and alternation of wetting and drying time in acid rain on the corrosion of 35CrMn and Q235 steel were investigated through the measurement of polarization curves, electrochemical impedance spectroscopy, x-ray diffraction, and quantum mechanical calculations. The corrosion rate of 35CrMn and Q235 steel increased with decreasing pH values of the simulated acid rain, whereas the corrosion potential of 35CrMn and Q235 steel became more negative. The impedance became higher and the corrosion rate decreased with increasing test time. The dissolution rate of samples increased with chloride ion concentration. Results suggested that the corrosion rate of 35CrMn steel was obviously lower than that of Q235 steel for a more compact rust, α-FeOOH. Quantum chemical calculations further revealed that the increase in corrosion rate of the steel resulted from pitting corrosion caused by the corrosive chloride ion.

  15. Radiation effects on interface reactions of U/Fe, U/(Fe+Cr), and U/(Fe+Cr+Ni)

    DOE PAGESBeta

    Shao, Lin; Chen, Di; Wei, Chaochen; Martin, Michael S.; Wang, Xuemei; Park, Youngjoo; Dein, Ed; Coffey, Kevin R.; Sohn, Yongho; Sencer, Bulent H.; et al

    2014-10-01

    We study the effects of radiation damage on interdiffusion and intermetallic phase formation at the interfaces of U/Fe, U/(Fe + Cr), and U/(Fe + Cr + Ni) diffusion couples. Magnetron sputtering is used to deposit thin films of Fe, Fe + Cr, or Fe + Cr + Ni on U substrates to form the diffusion couples. One set of samples are thermally annealed under high vacuum at 450 C or 550 C for one hour. A second set of samples are annealed identically but with concurrent 3.5 MeV Fe++ ion irradiation. The Fe++ ion penetration depth is sufficient to reachmore » the original interfaces. Rutherford backscattering spectrometry analysis with high fidelity spectral simulations is used to obtain interdiffusion profiles, which are used to examine differences in U diffusion and intermetallic phase formation at the buried interfaces. For all three diffusion systems, Fe++ ion irradiations enhance U diffusion. Furthermore, the irradiations accelerate the formation of intermetallic phases. In U/Fe couples, for example, the unirradiated samples show typical interdiffusion governed by Fick’s laws, while the irradiated ones show step-like profiles influenced by Gibbs phase rules.« less

  16. Radiation effects on interface reactions of U/Fe, U/(Fe+Cr), and U/(Fe+Cr+Ni)

    SciTech Connect

    Shao, Lin; Chen, Di; Wei, Chaochen; Martin, Michael S.; Wang, Xuemei; Park, Youngjoo; Dein, Ed; Coffey, Kevin R.; Sohn, Yongho; Sencer, Bulent H.; Rory Kennedy, J.

    2014-10-01

    We study the effects of radiation damage on interdiffusion and intermetallic phase formation at the interfaces of U/Fe, U/(Fe + Cr), and U/(Fe + Cr + Ni) diffusion couples. Magnetron sputtering is used to deposit thin films of Fe, Fe + Cr, or Fe + Cr + Ni on U substrates to form the diffusion couples. One set of samples are thermally annealed under high vacuum at 450 C or 550 C for one hour. A second set of samples are annealed identically but with concurrent 3.5 MeV Fe++ ion irradiation. The Fe++ ion penetration depth is sufficient to reach the original interfaces. Rutherford backscattering spectrometry analysis with high fidelity spectral simulations is used to obtain interdiffusion profiles, which are used to examine differences in U diffusion and intermetallic phase formation at the buried interfaces. For all three diffusion systems, Fe++ ion irradiations enhance U diffusion. Furthermore, the irradiations accelerate the formation of intermetallic phases. In U/Fe couples, for example, the unirradiated samples show typical interdiffusion governed by Fick’s laws, while the irradiated ones show step-like profiles influenced by Gibbs phase rules.

  17. Magnetic and structural properties of ferromagnetic Fe5PB2 and Fe5SiB2 and effects of Co and Mn substitutions

    DOE PAGESBeta

    McGuire, Michael A.; Parker, David S.

    2015-10-22

    Crystallographic and magnetic properties of Fe5PB2, Fe4CoPB2, Fe4MnPB2, Fe5SiB2, Fe4CoSiB2, and Fe4MnSiB2 are reported. All adopt the tetragonal Cr5B3 structure-type and are ferromagnetic at room temperature with easy axis of magnetization along the c-axis. The spin reorientation in Fe5SiB2 is observed as an anomaly in the magnetization near 170 K, and is suppressed by substitution of Co or Mn for Fe. The silicides are found to generally have larger magnetic moments than the phosphides, but the data suggests smaller magnetic anisotropy in the silicides. Cobalt substitution reduces the Curie temperatures by more than 100 K and ordered magnetic moments bymore » 16-20%, while manganese substitution has a much smaller effect. This suggests Mn moments align ferromagnetically with the Fe and that Co does not have an ordered moment in these structures. Anisotropic thermal expansion is observed in Fe5PB2 and Fe5SiB2, with negative thermal expansion seen along the c-axis of Fe5SiB2. First principles calculations of the magnetic properties of Fe5SiB2 and Fe4MnSiB2 are reported. The results, including the magnetic moment and anisotropy, and are in good agreement with experiment.« less

  18. Magnetotransport in La{sub 0.7}Sr{sub 0.3}MnO{sub 3}/CuCr{sub 2}O{sub 4}/Fe{sub 3}O{sub 4} magnetic junctions

    SciTech Connect

    Iwata-Harms, Jodi M.; Suzuki, Yuri; Chopdekar, Rajesh V.; Wong, Franklin J.; Nelson-Cheeseman, Brittany B.; Jenkins, Catherine A.; Arenholz, Elke

    2015-01-05

    We demonstrate distinct magnetic and resistive switching with junction magnetoresistance up to −6% in magnetic tunnel junctions with a CuCr{sub 2}O{sub 4} barrier. Junction magnetoresistance is inversely related to barrier thickness and reveals a maximum at a finite applied bias that converges to zero bias at low temperatures for all barrier thicknesses. The non-monotonic bias dependence is attributed to a charge gap from the Fe{sub 3}O{sub 4} electrode and possible spin filtering from the spin-split conduction band of the ferrimagnetic CuCr{sub 2}O{sub 4} barrier.

  19. Corrosion Behavior of Thermally Sprayed NiCrBSi Coating on 16MnR Low-Alloy Steel in KOH Solution

    NASA Astrophysics Data System (ADS)

    Zeng, Q.; Sun, J.; Emori, W.; Jiang, S. L.

    2016-05-01

    NiCrBSi coatings were selected as protective material and air plasma-sprayed on 16MnR low-alloy steel substrates. Corrosion behavior of 16MnR substrates and NiCrBSi coatings in KOH solution were evaluated by polarization resistance ( R p), potentiodynamic polarization curves, electrochemical impedance spectroscopy, and immersion corrosion tests. Electrolytes were solutions with different KOH concentrations. NiCrBSi coating showed superior corrosion resistance in KOH solution compared with the 16MnR. Corrosion current density of 16MnR substrate was 1.7-13.0 times that of NiCrBSi coating in the given concentration of KOH solution. By contrast, R p of NiCrBSi coating was 1.2-8.0 times that of the substrate, indicating that the corrosion rate of NiCrBSi coating was much lower than that of 16MnR substrate. Capacitance and total impedance value of NiCrBSi coating were much higher than those of 16MnR substrate in the same condition. This result indicates that corrosion resistance of NiCrBSi coating was better than that of 16MnR substrate, in accordance with polarization results. NiCrBSi coatings provided good protection for 16MnR substrate in KOH solution. Corrosion products were mainly Ni/Fe/Cr oxides.

  20. Compressibilities of MnFe2O4 polymorphs

    NASA Astrophysics Data System (ADS)

    Ye, Lijin; Zhai, Shuangmeng; Wu, Xiang; Xu, Chaowen; Yang, Ke; Higo, Yuji

    2015-07-01

    The high-pressure behavior and stability of synthetic jacobsite MnFe2O4 have been investigated up to 39.55 GPa at room temperature by means of in situ synchrotron X-ray diffraction using diamond anvil cell and multi-anvil high-pressure apparatus. The MnFe2O4 spinel undergoes a phase transition at about 18 GPa to form a denser antiferromagnetic CaMn2O4-type (CM afm ) polymorph. The CM afm MnFe2O4 is stable up to 39.55 GPa in this study and remains after decompression. Fitting the pressure-volume data using a third-order Birch-Murnaghan equation of state, the isothermal bulk modulus values and the first pressure derivatives were obtained as K 0 = 169.7 (35) GPa, = 2.87 (40) for spinel-type MnFe2O4 and K 0 = 149.2 (24) GPa, = 3.98 (19) for CM afm MnFe2O4, respectively. If is fixed to 4, K 0 was obtained as 160.6 (11) GPa for spinel-type MnFe2O4 and 148.9 (7) GPa for CM afm MnFe2O4. The effects of cation substitution on the isothermal bulk modulus and pressure for phase transition of Fe3+-bearing spinels were discussed.

  1. Magnetic properties of point defect interaction with impurity atoms in Fe-Cr alloys

    NASA Astrophysics Data System (ADS)

    Nguyen-Manh, D.; Lavrentiev, M. Yu.; Dudarev, S. L.

    2009-04-01

    An integrated ab initio and statistical Monte Carlo investigation has been recently carried out to model the thermodynamic and kinetic properties of Fe-Cr alloys. We found that the conventional Fe-Cr phase diagram is not adequate at low temperature region where the magnetic contribution to the free energy plays an important role in the prediction of an ordered Fe 15Cr phase and its negative enthalpy of formation. The origin of the anomalous thermodynamic and magnetic properties of Fe-Cr alloys can be understood using a tight-binding Stoner model combined with the charge neutrality condition. We investigate the environmental dependence of magnetic moment distributions for various self-interstitial atom <1 1 0> dumbbells configurations using spin density maps found using density functional theory calculations. The mixed dumbbell Fe-Cr and Fe-Mn binding energies are found to be positive due to magnetic interactions. Finally, we discuss the relationship between the migration energy of vacancy in Fe-Cr alloys and magnetism at the saddle point configuration.

  2. Noncollinear magnetism of Mn nanowires on Fe(1 1 0)

    NASA Astrophysics Data System (ADS)

    Igarashi, R. N.; Miranda, I. P.; Eleno, L. T. F.; Klautau, A. B.; Petrilli, H. M.

    2016-08-01

    Magnetic properties of Mn linear nanochains on a bcc Fe(1 1 0) surface have been studied using the first-principles real space-linear muffin-tin orbital atomic sphere approximation (RS–LMTO–ASA) method. We have considered up to nine Mn atoms deposited on bcc Fe(1 1 0). Our ab initio calculations reveal the competition between the antiferromagnetic Mn–Mn and Mn–Fe couplings, presenting a behavior which is very different from Mn nanowires on Fe(0 0 1), as shown in a previous publication. Due to this competition and non-negligible Dzyaloshinskii–Moriya interaction, noncollinear magnetic structures are stabilized as ground states for the Mn nanochains on Fe(1 1 0).

  3. Microstructure and mechanical behavior of Fe30Ni 20Mn35Al15 and modified Fe30Ni 20Mn35Al15 alloys

    NASA Astrophysics Data System (ADS)

    Meng, Fanling

    A novel alloy with nominal composition Fe30Ni 20Mn35Al15 has been found to show good room-temperature strength and significant ductility. The current project is to study the wear properties of as-cast Fe30Ni20Mn35Al 15 and discuss the possibility of further improving the mechanical properties of this alloy. The dry sliding wear of as-cast Fe30Ni20Mn 35Al15 was studied in in four different environments, i.e. air, dry oxygen, dry argon and a 4% hydrogen/nitrogen mixture. Two-body and three-body abrasive wear mechanism was found for tests in oxygen-containing environments, while plastic flow mechanisms dominated the wear behavior for tests in argon. Hydrogen embrittlement led to 1000% increase of wear loss by causing more rapid crack nucleation of the asperities. The effects of different additions of chromium (≤ 8 at. %) on both microstructure and fracture behavior of Fe30Ni20Mn 35Al15 were investigated. All alloys consisted of (Ni, Al)-rich B2 and (Fe, Mn)-rich f.c.c. phases with most of the Cr residing in the f.c.c. phase. The addition of 6 at. % Cr not only increased the room temperature ductility, but also completely suppressed the environmental embrittlement observed in the Cr-free alloy at low strain rates. The effects of varying the Al concentration on the microstructures and tensile properties of six two-phase FeNiMnAl alloys with a composition close to Fe30Ni20Mn35Al15 were studied. The increase in f.c.c. volume fraction and f.c.c. lamellar width led to an increase in ductility and a decrease in yield strength. The correlation between the yield stress and f.c.c. lamellar spacing lambda obeyed a Hall-Petch-type relationship, i.e. sigmay=252+0.00027lambda-1, where the units for sigmay and lambda are MPa and meter, respectively. FeNiMnAl alloy with B2 and f.c.c. phases aligned along was reported to show high strength at room temperature. The mechanical properties of Fe 28Ni18Mn33Al21, consisting of (Ni, Al)-enriched B2 and (Fe, Mn)-enriched f.c.c. phases with

  4. The Fe/Mn constraint on precursors of basaltic achondrites

    NASA Technical Reports Server (NTRS)

    Delaney, Jeremy S.; Boesenberg, Joseph S.

    1993-01-01

    Most achondritic meteorites have Fe/Mn ratios that are lower than those of carbonaceous chondrites and of course are lower than the solar system abundance ratio of these elements. Models of the origin of achondritic assemblages must, therefore, account for these ratios. Fe/Mn ratios are suggested to be distinctive for samples from each achondrite parent body and for the Earth and Moon, but the correspondence between the Fe/Mn systematics of achondrites and chondritic precursors is unclear. Most models of achondrite genesis involve magmatic differentiation of chondritic precursors. The Fe/Mn difference between achondrites and chondrites is particularly significant since Fe and Mn are geochemically similar elements with similar partitioning behavior in familiar magmatic systems and are generally coupled during crystal-liquid fractionation. In contrast, however, Mn is more volatile than Fe in a nebular setting. Variation of Fe/Mn ratios based on the relative volatility of these elements in the early nebula provides a constraint for models by which the basaltic achondrites (with Fe/Mn ratios approximately = 25-50) are derived from mixtures of nebular components that were enriched in volatile components such as Mn. However, such volatile enriched components have not been identified in chondrites. When the abundance in achondrites of elements of similar volatility is examined, anomalies appear. For example, Na is massively depleted in basaltic achondrites when compared to Mn. These anomalies might be explained using current models but the alternative hypothesis, that Fe/Mn ratio is controlled not by nebular volatility constraints, but by planetary differentiation should be explored.

  5. Fe/Mn in olivine of carbonaceous meteorites

    NASA Technical Reports Server (NTRS)

    Steele, Ian M.

    1993-01-01

    Olivines in primitive meteorites show a range of Fe/Mn both within one grain and among grains suggesting that they have recorded changing conditions during or after growth. Because olivine should be an early forming phase, Fe/Mn is used here to infer these earliest conditions. Initial Fe/Mn in cores of isolated, euhedral forsterite in both C2 and C3 meteorites ranges from 25 to 35 but differs at grain edge. Murchison (C2) forsterites show Fe/Mn approaching 1.0 at the grain edge while Ornans Fe/Mn is near 60 at grain edge. These values are lower than the matrix Fe/Mn for both meteorites and the distinct difference in zoning profile indicates different processes operating during and after grain growth. The Fe/Mn of bulk samples from a particular source such as the Moon is nearly constant. Individual samples show variation suggesting that there is some fractionation of Mn from Fe. Minerals have their individual ranges of Fe/Mn which has been used to recognize different types of olivine within one meteorite. Extreme values of Fe/Mn below 1.0 occur in forsterite from some IDP's, UOC matrix, and C1 meteorites. There are apparently no detailed studies of Fe/Mn variation within single olivine grains. Forsterite grains in C2 and C3 carbonaceous chondrites show complex zoning, and the nearly pure forsterites (Fo greater than approximately 99.5) have high levels of some minor elements including Ti, Al, V, and Sc. There is disagreement on the original source of these grains and both chondrule and vapor growth have been proposed. In addition, there is clear evidence that diffusion has affected the outer margins but in some cases the whole grain. Within the cores, the FeO range is limited, and if growing under constant conditions, the Fe/Mn should be near constant as there is little fractionation of Mn from Fe by forsterite. Additionally, there are apparently no co-crystallizing phases as evidenced by a lack of common inclusions in the forsterites. These observations are now

  6. Interaction UMo fuel with Fe and FeCr

    NASA Astrophysics Data System (ADS)

    Nikitin, S. N.; Shornikov, D. P.; Tarasov, B. A.; Baranov, V. G.

    2016-04-01

    Uranium-molybdenum alloys are perspective nuclear fuel for fast reactors. In this work, a study was conducted of the interaction of uranium-molybdenum alloy with iron and chromium steel at an elevated temperature of 750 °C for 5 hours. It was found that the constant rate of the interaction layer growth for diffusion couple UMo/FeCr is about 5.4-10-12 m2/s at 750 °C. The phase composition of the interaction layers for the both diffusion couples was determined. The interaction comes along the grain boundaries, there are not interacts UMo alloy grain in the structure of the diffusion zone.

  7. Incinerating volatile organic compounds with ferrospinel catalyst MnFe2O4: an example with isopropyl alcohol.

    PubMed

    Lou, Jie-Chung; Tu, Yao-Jen

    2005-12-01

    This paper concerns the incineration of isopropyl alcohol (IPA) using the ferrospinel catalyst MnFe2O4. It covers the preparation of the ferrospinel catalyst, the screening of catalytic activity, catalytic incineration testing, and 72-hr decay testing of the catalyst. The experimental results of catalyst screening reveal that the Mn/Fe catalyst is the best of five prepared catalysts (chromium/iron [Cr/Fe], manganese/iron [Mn/Fe], zinc/iron [Zn/Fe], nickel/iron [Ni/Fe], and pure magnetite [Fe3O4]). In tests of the catalytic incineration system used to convert IPA, 98% conversion was obtained at a space velocity of 24,000 hr(-1), an oxygen (O2) content of 21%, 1700 ppm of IPA, and a reaction temperature of 200 degrees C.

  8. Collinear spin-density-wave ordering in Fe/Cr multilayers and wedges

    SciTech Connect

    Fishman, R.S.; Shi, Z.

    1999-06-01

    {acute e}el temperature. Model II also predicts that the {ital I} SDW may undergo a single phase transition from n=m to m{minus}1 before disappearing above T{sub N}(N). This behavior has recently been confirmed by neutron-scattering measurements on CrMn/Cr multilayers. While model I very successfully predicts the behavior of Fe/Cr/Fe wedges, a refined version of model II describes some properties of sputtered Fe/Cr multilayers. {copyright} {ital 1999} {ital The American Physical Society}

  9. Magnetic phase transitions in epitaxial Fe/Cr superlattices

    SciTech Connect

    Fullerton, E.E.; Sowers, C.H.; Bader, S.D.; Riggs, K.T.; Berger, A.

    1995-12-31

    The surface spin-flop and Neel transitions are examined in Fe/Cr superlattices. The surface spin-flop, originally predicted by Mills [Phys. Rev. Lett. 20, 18 (1968)], is observed in Fe/Cr(211) superlattices with antiferromagnetic interlayer coupling and uniaxial in-plane-anisotropy. The Neel transition (T{sub N}) of Cr is observed in Fe/Cr(001) superlattices, for which the onset of antiferromagnetism is at a thickness t{sub Cr} of 42{angstrom}. The bulk value of T{sub N} is approached asymptotically as t{sub Cr} increases and is characterized by a three-dimensional shift exponent. These T{sub N} results are attributed to finite-size effects and spin-frustration near rough Fe-Cr interfaces.

  10. Dissimilatory Fe(III) and Mn(IV) reduction.

    PubMed Central

    Lovley, D R

    1991-01-01

    The oxidation of organic matter coupled to the reduction of Fe(III) or Mn(IV) is one of the most important biogeochemical reactions in aquatic sediments, soils, and groundwater. This process, which may have been the first globally significant mechanism for the oxidation of organic matter to carbon dioxide, plays an important role in the oxidation of natural and contaminant organic compounds in a variety of environments and contributes to other phenomena of widespread significance such as the release of metals and nutrients into water supplies, the magnetization of sediments, and the corrosion of metal. Until recently, much of the Fe(III) and Mn(IV) reduction in sedimentary environments was considered to be the result of nonenzymatic processes. However, microorganisms which can effectively couple the oxidation of organic compounds to the reduction of Fe(III) or Mn(IV) have recently been discovered. With Fe(III) or Mn(IV) as the sole electron acceptor, these organisms can completely oxidize fatty acids, hydrogen, or a variety of monoaromatic compounds. This metabolism provides energy to support growth. Sugars and amino acids can be completely oxidized by the cooperative activity of fermentative microorganisms and hydrogen- and fatty-acid-oxidizing Fe(III) and Mn(IV) reducers. This provides a microbial mechanism for the oxidation of the complex assemblage of sedimentary organic matter in Fe(III)- or Mn(IV)-reducing environments. The available evidence indicates that this enzymatic reduction of Fe(III) or Mn(IV) accounts for most of the oxidation of organic matter coupled to reduction of Fe(III) and Mn(IV) in sedimentary environments. Little is known about the diversity and ecology of the microorganisms responsible for Fe(III) and Mn(IV) reduction, and only preliminary studies have been conducted on the physiology and biochemistry of this process. PMID:1886521

  11. Neutron diffraction and reflectivity studies of the Cr Neel transition in Fe/Cr(001) superlatices

    SciTech Connect

    Fullerton, E.E.; Adenwalla, S.; Felcher, G.P.

    1995-12-31

    The effects on the interlayer coupling of the Cr Neel transition is studied in Fe/Cr(001) superlattices. The Neel transition is suppressed for Cr layer thickness < 42 {angstrom}. For > 42{angstrom} of Cr, the Neel temperature TN initially increases rapidly and then asymptotically approaches its bulk value with a three-dimensional transition-temperature shift exponent value of {lambda}=1.4{+-}0.3. Neutron diffraction confirms both the Cr antiferromagnetic order and the existence of the incommensurate, transverse spin density wave whose nesting wavevector is the same as that of bulk Cr. The ordering of the Cr dramatically alters the coupling of the Fe layers. The biquadratic Fe interlayer coupling observed for T>T{sub N} vanishes below T{sub N} as confirmed by polarized neutron reflectivity. The behavior can be understood in terms of finite-size and spin frustration effects at rough Fe-Cr interfaces.

  12. Cr(III) Oxidation Coupled With Microbially-Mediated Mn(II) Oxidation

    SciTech Connect

    Youxian Wu; Baolin Deng

    2006-04-05

    Cr(VI) can be reduced to less toxic and mobile Cr(III) species through abiotic and biological processes. Reductive immobilization of Cr(VI) has been widely explored as a cost effective technology for site remediation; Mn oxides are regarded as primary oxidants for Cr(III) oxidation in the environment; and Generation of Mn oxides from Mn(II) in natural environments is believed to be biologically catalyzed.

  13. Textures of strip cast Fe16%Cr

    SciTech Connect

    Raabe, D.; Reher, F.; Luecke, K. ); Hoelscher, M. )

    1993-07-01

    Ferritic stainless steels with a Cr content of 16% are mainly manufactured by continuous casting, hot rolling, cold rolling and final recrystallization. The recent development of the strip casting method, which provides sheets with an equivalent geometry, i.e. thickness and width as the hot rolled band, yields significant improvements in comparison to the conventional processing. The weak initial strip texture and the homogeneous microstructure through the sample thickness have shown evidence of avoiding the well known ridging phenomenon of the finally rolled and annealed product. The occurrence of ridging in conventionally processed FeCr steel has been attributed to the collective shear of grains with (hkl)<110>, i.e. [alpha]-fibre orientations, which become oriented and topologically arranged during hot rolling. In the present paper the textures of a stainless ferritic steel with 16% Cr and 0.02% C, strip casted (SC) as well as hot rolled (HR), were thus investigated. The textures were examined by measuring the four incomplete pole figures (110), (200), (112) and (103) in the back reflection mode. The orientation distribution function (ODF) was calculated by the series expansion method (1[sup max]=22). In the case of cubic crystal symmetry and orthorhombic sample symmetry an orientation can then be presented by the three Euler angles [var phi][sub 1], [var phi], [var phi][sub 2] in the reducted Euler space. Since bcc steels tend to develop characteristic fibre textures, it is favorable to present the ODFs as isointensity diagrams in [var phi][sub 1]-sections through the Eulerspace. In this work the [alpha]-fibre and the [gamma]-fibre are of major interest.

  14. Synthesis, dielectric behavior and impedance measurement studies of Cr-substituted Zn-Mn ferrites

    SciTech Connect

    Hankare, P.P.; Patil, R.P.; Garadkar, K.M.; Sasikala, R.; Chougule, B.K.

    2011-03-15

    Graphical abstract: Variation of dielectric constant with frequency. Research highlights: {yields} Sol-gel route synthesized spherical crystalline nanoparticles of ZnMn{sub 1-x}Cr{sub x}FeO{sub 4}. {yields} XRD, DTA, FTIR, SEM, dielectric and impedance study. {yields} The ferrites show concentration dependence of ac electrical conductivity. {yields} Impedance response is dominated by grain boundary behavior. -- Abstract: Nanocrystalline ZnMn{sub 1-x}Cr{sub x}FeO{sub 4} (1.0 {>=} x {>=} 0) ferrites were synthesized by sol-gel technique. X-ray diffraction (XRD) confirmed the formation of single phasic cubic spinel lattice for all the compositions studied. Lattice parameter shows a decreasing trend with an increase in Cr content in the compositions. Formation of spherical nanoparticles was revealed by scanning electron microscopy (SEM) analysis. Infrared spectroscopic studies revealed two main absorption bands in the range 400-800 cm{sup -1} arising due to tetrahedral (A) and octahedral (B) site vibrations. Dielectric constant, dielectric loss tangent, ac conductivity and complex impedance were measured as a function of frequency in the range 20 Hz to 1 MHz. Frequency dependence of dielectric constant shows dielectric dispersion due to the Maxwell-Wagner type of interfacial polarization. The role of chromium in modifying structural and dielectric properties of these ferrites has been explained.

  15. Magnetism in Endohedral Metallofullerenes TM@Cn for n = 20, 28, 32, 36 where TM = Ti, V, Cr, Mn, Fe, Co, Ni and Cu: A Spin Polarized Density Functional Study

    NASA Astrophysics Data System (ADS)

    Sharma, Hitesh; Garg, Isha; Dharamvir, Keya; Jindal, V. K.

    2010-10-01

    A systematic investigation of 3d transition metal (TM)encapsulated inside small fullerene cages has been performed to calculate their magnetic properties using first principle methods. The total magnetic moment (MM) of TM@Cn complexes is delocalized between TM site and induced MM on carbon (C) atoms. There is a significant MM of 0.12-0.05μB induced on the cage C atoms. The 3d TM atoms interact ferromagnetically (FM) with C atoms of C20 and C32 cage except for Ni@C28 which interacts anti-ferromagnetically. The magnetic interactions are found to change from FM to AFM in C32 for Ti, V, Cr and Mn and the MM gets quenched for Ni@Cn for n>32. The total MM does not show any change in Mn@Cn for all cages although FM to AFM change does take place for n = 32. The cohesive energy of TM@Cn suggests Ti and V are stable inside all the cages considered.

  16. Behavior of Fe-Mn-Al-C steels during cyclic tests

    NASA Astrophysics Data System (ADS)

    Kalashnikov, I. S.; Acselrad, O.; Pereira, L. C.; Kalichak, T.; Khadyyev, M. S.

    2000-06-01

    Alloys of the FeMnAlC system have been used for cryogenic purposes and for applications up to 673 K. At low temperatures, they have in general a better performance than austenitic Cr-Ni steels as far as fatigue is concerned, but are inferior to martensitic Cr steels. However, since the fatigue strength of FeMnAlC alloys in the temperature range of 523 to 823 K is higher than at room temperature, the present work has been conducted to describe the behavior of such alloys under the action of cyclic loading, including elasto-plastic deformation and cyclic temperatures. It has been concluded that components can be successfully subjected to cyclic loads in the elasto-plastic regime and to periodic changes in temperature under normal service conditions.

  17. Electrochemical Studies of Passive Film Stability on Fe49.7Cr17.7Mn1.9Mo7.4W1.6B15.2C3.8Si2.4 Amorphous Metal in Seawater at 90oCElectrochemical Studies of Passive Film Stability on Fe49.7Cr17.7Mn1.9Mo7.4W1.6B15.2C3.8Si2.4 Amorphous Metal in Seawater at 9

    SciTech Connect

    Farmer, J C; Haslam, J; Day, S D; Lian, T; Saw, C K; Hailey, P D; Choi, J S; Rebak, R B; Yang, N; Payer, J H; Perepezko, J H; Hildal, K; Lavernia, E J; Ajdelsztajn, L; Branagan, D J; Buffa, E J; Aprigliano, L F

    2007-04-25

    An iron-based amorphous metal, Fe{sub 49.7}Cr{sub 17.7}Mn{sub 1.9}Mo{sub 7.4}W{sub 1.6}B{sub 15.2}C{sub 3.8}Si{sub 2.4} (SAM2X5), with very good corrosion resistance was developed. This material was prepared as a melt-spun ribbon, as well as gas atomized powder and a thermal-spray coating. During electrochemical testing in several environments, including seawater at 90 C, the passive film stability was found to be comparable to that of high-performance nickel-based alloys, and superior to that of stainless steels, based on electrochemical measurements of the passive film breakdown potential and general corrosion rates. This material also performed very well in standard salt fog tests. Chromium (Cr), molybdenum (Mo) and tungsten (W) provided corrosion resistance, and boron (B) enabled glass formation. The high boron content of this particular amorphous metal made it an effective neutron absorber, and suitable for criticality control applications. This material and its parent alloy maintained corrosion resistance up to the glass transition temperature, and remained in the amorphous state during exposure to relatively high neutron doses.

  18. Molecular orbital (SCF-X-α-SW) theory of Fe2+-Mn3+, Fe3+-Mn2+, and Fe3+-Mn3+ charge transfer and magnetic exchange in oxides and silicates

    USGS Publications Warehouse

    Sherman, David M.

    1990-01-01

    Metal-metal charge-transfer and magnetic exchange interactions have important effects on the optical spectra, crystal chemistry, and physics of minerals. Previous molecular orbital calculations have provided insight on the nature of Fe2+-Fe3+ and Fe2+-Ti4+ charge-transfer transitions in oxides and silicates. In this work, spin-unrestricted molecular orbital calculations on (FeMnO10) clusters are used to study the nature of magnetic exchange and electron delocalization (charge transfer) associated with Fe3+-Mn2+, Fe3+-Mn3+, and Fe2+-Mn3+ interactions in oxides and silicates. 

  19. Cyclic and isothermal oxidation behavior at 1100 and 1200 C of Ni-20Cr, Ni-20Cr-3Mn, Ni-20Cr-3Si, and Ni-40Cr alloys

    NASA Technical Reports Server (NTRS)

    Lowell, C. E.

    1973-01-01

    Alloys of Ni-20Cr, Ni-20Cr-3Mn, Ni-20Cr-3Si, and Ni-40Cr were cyclically oxidized at 1100 and 1200 C for up to 100 hours. Oxidation behavior was judged by sample thickness and weight change, metallography, diffraction, and microprobe analysis. The least attacked were Ni-40Cr and Ni-20Cr-3Si. The alloy Ni-20Cr-3Mn was much less attacked than Ni-20Cr, but more than the other alloys. The formation of Cr2O3 accounted for the increased resistance of Ni-Cr and Ni-20Cr-3Si, and the formation of MnCr2O4 accounts for the improvement in Ni-20Cr-3mn over Ni-20Cr.

  20. Cr(OH)₃(s) Oxidation Induced by Surface Catalyzed Mn(II) Oxidation

    SciTech Connect

    Namgung, Seonyi; Kwon, M.; Qafoku, Nikolla; Lee, Gie Hyeon

    2014-09-16

    This study examined the feasibility of Cr(OH)₃(s) oxidation mediated by surface catalyzed Mn(II) oxidation under common groundwater pH conditions as a potential pathway of natural Cr(VI) contaminations. Dissolved Mn(II) (50 μM) was reacted with or without synthesized Cr(OH)₃(s) (1.0 g/L) at pH 7 – 9 under oxic or anoxic conditions. In the absence of Cr(OH)₃(s), homogeneous Mn(II) oxidation by dissolved O₂ was not observed at pH ≤ 8.0 for 50 d. At pH 9.0, by contrast, dissolved Mn(II) was completely removed within 8 d and precipitated as hausmannite. When Cr(OH)₃(s) was present, this solid was oxidized and released substantial amounts of Cr(VI) as dissolved Mn(II) was added into the suspension at pH ≥ 8.0 under oxic conditions. Our results suggest that Cr(OH)₃(s) was readily oxidized by a newly formed Mn oxide as a result of Mn(II) oxidation catalyzed on Cr(OH)₃(s) surface. XANES analysis of the residual solids after the reaction between 1.0 g/L Cr(OH)₃(s) and 204 μM Mn(II) at pH 9.0 for 22 d revealed that the product of surface catalyzed Mn(II) oxidation resembled birnessite. The rate and extent of Cr(OH)₃(s) oxidation was likely controlled by those of surface catalyzed Mn(II) oxidation as the production of Cr(VI) increased with increasing pH and initial Mn(II) concentrations. This study evokes the potential environmental hazard of sparingly soluble Cr(OH)₃(s) that can be a source of Cr(VI) in the presence of dissolved Mn(II).

  1. Negative-Electrode Catalysts for Fe/Cr Redox Cells

    NASA Technical Reports Server (NTRS)

    Gahn, R. F.; Hagedorn, N.

    1987-01-01

    Electrodes perform more consistently and less expensive. Surfaces catalyzed by bismuth and bismuth/lead developed for application on chromium electrode in iron/chromium redox electrochemical energy storage system. NASA Fe/Cr storage system incorporates two soluble electrodes consisting of acidified solutions of iron chloride (FeC13 and FeC12) and chromium chloride (CrC13 and CrC12) oxidized and reduced in power-conversion unit to store and produce electricity. Electrolytes circulated with pumps and stored in external tanks.

  2. Bulk modulus and specific heat of B-site doped (La{sub 0.3}Pr{sub 0.7}){sub 0.65}Ca{sub 0.35}Mn{sub 1−x}B{sub x}O{sub 3} (B=Fe, Cr, Ru, Al, Ga)

    SciTech Connect

    Srivastava, Archana; Thakur, Rasna; Gaur, N. K.

    2014-04-24

    Specific heat (C{sub p}) thermal expansion (α) and Bulk modulus (B{sub T}) of lightly doped Rare Earth manganites (La{sub 0.3}Pr{sub 0.7}){sub 0.65}Ca{sub 0.35}Mn{sub 1−x}B{sub x}O{sub 3} (B{sup 3+} = Fe{sup 3+},Cr{sup 3+},Ga{sup 3+},Al{sup 3+},Ru4+); (0.3Mn{sub 0.97}Fe{sub 0.03}O{sub 3} as a function of temperature (10K≤T≤ 200K) is found to be in agreement with the published data. The trend of variation of Debye temperature with B-site cationic radius is predicted probably for the first time for the B-site doped rare earth manganites.

  3. Nucleation of Cr precipitates in Fe-Cr alloy under irradiation

    SciTech Connect

    Dai, Y. Y.; Ao, L.; Sun, Qing- Qiang; Yang, L.; Nie, JL; Peng, SM; Long, XG; Zhou, X. S.; Zu, Xiaotao; Liu, L.; Sun, Xin; Terentyev, Dimtry; Gao, Fei

    2015-04-01

    The nucleation of Cr precipitates induced by overlapping of displacement cascades in Fe-Cr alloys has been investigated using the combination of molecular dynamics (MD) and Metropolis Monte Carlo (MMC) simulations. The results reveal that the number of Frenkel pairs increases with the increasing of overlapped cascades. Overlapping cascades could promote the formation of Cr precipitates in Fe-Cr alloys, as analyzed using short range order (SRO) parameters to quantify the degree of ordering and clustering of Cr atoms. In addition, the simulations using MMC approach show that the presence of small Cr clusters and vacancy clusters formed within cascade overlapped region enhance the nucleation of Cr precipitates, leading to the formation of large Cr dilute precipitates.

  4. Chemical zoning and diffusion of Ca, Al, Mn, and Cr in olivine of springwater pallasite

    NASA Technical Reports Server (NTRS)

    Zhou, Y.; Steele, Ian M.

    1993-01-01

    The pallasites, consisting mainly of Fe-Ni metal and olivine, are thought to represent the interior of a planetary body which slowly cooled from high temperature. Although the olivines are nearly homogeneous, ion microprobe studies revealed variations of Ca, Ti, Co, Cr, and Ni near grain edges. These variations were thought to represent diffusion in response to falling temperature of the parent body. Pallasite cooling rates have been estimated based on kamacite taenite textures but results differ by x100. In principle elemental profiles in olivine can allow estimates of cooling rate if diffusion coefficients are known; in addition, given a cooling rate, diffusion coefficients could be derived. Data are presented which show that apparent diffusion profiles can be measured for Al, Ca, Cr, and Mn which qualitatively agree with expected diffusion rates and have the potential of providing independent estimates of pallasite cooling rates.

  5. Magnetic phase transitions in epitaxial Fe/Cr superlattices

    SciTech Connect

    Fullerton, E.E.

    1995-07-01

    Fe/Cr superlattices exhibit a variety of intriguing magnetic properties not observed in bulk materials. Examples include oscillatory interlayer coupling and giant magnetoresistance. Growth of epitaxial superlattices allows the interlayer coupling and magnetic anisotropy to be tailored to probe rather subtle magnetic ordering transitions of thin-film antiferromagnets. The author discusses two such transitions, the surface spin-flop transition in Fe/Cr(211) superlattices and the Neel transition of thin Cr layers in proximity with Fe in Fe/Cr(001) superlattices. The surface spin-flop transition is a first-order, field-induced phase transition in antiferromagnets with uniaxial magnetic anisotropy and the field applied along the easy direction. In Fe/Cr(100) superlattices, the antiferromagnetic ordering of the Cr spacers results in anomalies in a variety of physical properties. The transition temperature is strongly Cr thickness dependent. A `transition-temperature shift exponent` is extracted from the data in the thick Cr regime (< 160 {angstrom}) and discussed in terms of a combination of finite-size and spin-frustration effects.

  6. CASSCF/CI calculations for first row transition metal hydrides - The TiH(4-phi), VH(5-delta), CrH(6-sigma-plus), MnH(7-sigma-plus), FeH(4,6-delta) and NiH(2-delta) states

    NASA Technical Reports Server (NTRS)

    Walch, S. P.; Bauschlicher, C. W., Jr.

    1983-01-01

    Calculations are performed for the predicted ground states of TiH(4-phi), VH(5-delta), CrH(6-sigma-plus), MnH(7-sigma-plus), Fett(4,6-delta) and NiH(2-delta). For FeH both the 6-delta and 4-delta states are studied, since both are likely candidates for the ground state. The ground state symmetries are predicted based on a combination of atomic coupling arguments and coupling of 4s(2)3d(n) and 4s(1)3d(n+1) terms in the molecular system. Electron correlation is included by a CASSCF/CI (SD) treatment. The CASSCF includes near-degeneracy effects, while correlation of the 3d electrons in included at the CI level.

  7. Cr(OH)3(s) oxidation induced by surface catalyzed Mn(II) oxidation.

    PubMed

    Namgung, Seonyi; Kwon, Man Jae; Qafoku, Nikolla P; Lee, Giehyeon

    2014-09-16

    We examined the feasibility of Cr(OH)3(s) oxidation mediated by surface catalyzed Mn(II) oxidation under common groundwater pH conditions as a potential pathway of natural Cr(VI) contaminations. Dissolved Mn(II) (50 μM) was reacted with or without synthesized Cr(OH)3(s) (1.0 g/L) at pH 7.0-9.0 under oxic or anoxic conditions. Homogeneous Mn(II) oxidation by dissolved O2 was not observed at pH ≤ 8.0 for 50 days. At pH 9.0, by contrast, dissolved Mn(II) was completely removed within 8 days and precipitated as hausmannite. When Cr(OH)3(s) was present, this solid was oxidized and released substantial amounts of Cr(VI) as dissolved Mn(II) was added into the suspension at pH ≥ 8.0 under oxic conditions. Production of Cr(VI) was attributed to Cr(OH)3(s) oxidation by a newly formed Mn oxide via Mn(II) oxidation catalyzed on Cr(OH)3(s) surface. XANES results indicated that this surface-catalyzed Mn(II) oxidation produced a mixed valence Mn(III/IV) solid phase. Our results suggest that toxic Cr(VI) can be naturally produced via Cr(OH)3(s) oxidation coupled with the oxidation of dissolved Mn(II). In addition, this study evokes the potential environmental hazard of sparingly soluble Cr(OH)3(s), which has been considered the most common and a stable remediation product of Cr(VI) contamination.

  8. Study of intergranular embrittlement in Fe-12Mn alloys

    SciTech Connect

    Lee, H.J.

    1982-06-01

    A high resolution scanning Auger microscopic study has been performed on the intergranular fracture surfaces of Fe-12Mn steels in the as-austenitized condition. Fracture mode below the ductile-brittle transition temperature was intergranular whenever the alloy was quenched from the austenite field. The intergranular fracture surface failed to reveal any consistent segregation of P, S, As, O, or N. The occasional appearance of S or O on the fracture surface was found to be due to a low density precipitation of MnS and MnO/sub 2/ along the prior austenite boundaries. An AES study with Ar/sup +/ ion-sputtering showed no evidence of manganese enrichment along the prior austenite boundaries, but a slight segregation of carbon which does not appear to be implicated in the tendency toward intergranular fracture. Addition of 0.002% B with a 1000/sup 0/C/1h/WQ treatment yielded a high Charpy impact energy at liquid nitrogen temperature, preventing the intergranular fracture. High resolution AES studies showed that 3 at. % B on the prior austenite grain boundaries is most effective in increasing the grain boundary cohesive strength in an Fe-12Mn alloy. Trace additions of Mg, Zr, or V had negligible effects on the intergranular embrittlement. A 450/sup 0/C temper of the boron-modified alloys was found to cause tempered martensite embrittlement, leading to intergranular fracture. The embrittling treatment of the Fe-12Mn alloys with and without boron additions raised the ductile-brittle transition by 150/sup 0/C. This tempered martensite embrittlement was found to be due to the Mn enrichment of the fracture surface to 32 at. % Mn in the boron-modified alloy and 38 at. % Mn in the unmodified alloy. The Mn-enriched region along the prior austenite grain boundaries upon further tempering is believed to cause nucleation of austenite and to change the chemistry of the intergranular fracture surfaces. 61 figures.

  9. V, Cr, and Mn in the earth, moon, EPB, and SPB and the origin of the moon - Experimental studies

    NASA Technical Reports Server (NTRS)

    Drake, Michael J.; Capobianco, Christopher J.; Newsom, Horton E.

    1989-01-01

    The abundances of V, Cr, and Mn inferred for the mantles of the earth and moon decrease in that order and are similar in both mantles (but distinct from those in the mantles of the Eucrite Parent Body and Shergottite Parent Body), suggesting a common origin for the mantles of the earth and the moon. This hypothesis was investigated on the basis of a comparison between the depletions of V, Cr, and Mn in the mantles of the earth and the moon, and the metal/silicate partition coefficients of these elements at 1260 C and 1 bar pressure among a S-bearing metallic liquid, a silicate melt, and a FeNi alloy. It was found that the earth and the moon depletions of V, Cr, and Mn are not correlated with metal/silicate partition coefficients; the V and Cr partitioned into S-rich metallic liquids under reducing conditions more strongly than Mn, consistent with the relative volatilities of these elements. This indicates that the depletion patterns of these elements in the mantles of the earth and moon cannot be attributed primarily to terrestrial core formation.

  10. Preparation, structural and magnetic characterization of DyCrMnO 5

    NASA Astrophysics Data System (ADS)

    Martínez-Lope, M. J.; Retuerto, M.; García-Hernández, M.; Alonso, J. A.

    2009-03-01

    The title compound has been first synthesized by a citrate technique followed by thermal treatments under moderate oxygen pressure conditions, and characterized by X-ray and neutron powder diffraction (NPD) and magnetization measurements. The crystal structure of DyCrMnO 5 has been refined from NPD data in the space group Pbam; a=7.2617(6) Å, b=8.5161(6) Å, and c=5.7126(5) Å at 295 K. This oxide is isostructural with RMn 2O 5 oxides ( R=rare earths) and it contains infinite chains of (Cr, Mn) 4+O 6 octahedra-sharing edges, linked together by (Mn, Cr) 3+O 5 pyramids and DyO 8 units. The high degree of antisite disordering exhibited by DyCrMnO 5 is noteworthy. The octahedral positions are occupied by roughly 50% of Mn and Cr cations, and the pyramidal groups contain two thirds of Mn and one third of Cr cations. We assume that Mn and Cr cations at the octahedral positions exhibit a tetravalent oxidation state, whereas the metals at the pyramidal positions are trivalent, in order to preserve the electroneutrality of this oxide. The susceptibility vs temperature curve of DyCrMnO 5 does not suggest the establishment of a long-range magnetic structure even at low temperatures; the NPD technique does not provide any signal of magnetic ordering, since the reflections do not show any magnetic contribution.

  11. Synergetic effects of Mn and Si in the interaction with point defects in bcc Fe

    NASA Astrophysics Data System (ADS)

    Bakaev, A.; Terentyev, D.; He, X.; Van Neck, D.

    2014-12-01

    The interaction of Mn, Si and Cr with a vacancy and self-interstitial defects in BCC Fe has been analyzed using ab initio calculations. While the interaction of the considered solute clusters with a single vacancy is linearly additive, there is a considerable synergetic effect in the case of self-interstitial atoms, found to bind strongly with Mn-Si pairs. The latter therefore act as deep trapping configurations for self-interstitials. At the same time, the presence of the point defects nearby weakly attractive Mn-Si pairs significantly enhances the solute-solute binding. The revealed effects are rationalized on the basis of charge density and local magnetic moment distributions.

  12. Arsenate uptake and arsenite simultaneous sorption and oxidation by Fe-Mn binary oxides: influence of Mn/Fe ratio, pH, Ca2+, and humic acid.

    PubMed

    Zhang, Gaosheng; Liu, Huijuan; Qu, Jiuhui; Jefferson, William

    2012-01-15

    Arsenate retention, arsenite sorption and oxidation on the surfaces of Fe-Mn binary oxides may play an important role in the mobilization and transformation of arsenic, due to the common occurrence of these oxides in the environment. However, no sufficient information on the sorption behaviors of arsenic on Fe-Mn binary oxides is available. This study investigated the influences of Mn/Fe molar ratio, solution pH, coexisting calcium ions, and humic acids have on arsenic sorption by Fe-Mn binary oxides. To create Fe-Mn binary oxides, simultaneous oxidation and co-precipitation methods were employed. The Fe-Mn binary oxides exhibited a porous crystalline structure similar to 2-line ferrihydrite at Mn/Fe ratios 1:3 and below, whereas exhibited similar structures to δ-MnO(2) at higher ratios. The As(V) sorption maximum was observed at a Mn/Fe ratio of 1:6, but As(III) uptake maximum was at Mn/Fe ratio 1:3. However, As(III) adsorption capacity was much higher than that of As(V) at each Mn/Fe ratio. As(V) sorption was found to decrease with increasing pH, while As(III) sorption edge was different, depending on the content of MnO(2) in the binary oxides. The presence of Ca(2+) enhanced the As(V) uptake under alkaline pH, but did not significantly influence the As(III) sorption by 1:9 Fe-Mn binary oxide; whereas the presence of humic acid slightly reduced both As(V) and As(III) uptake. These results indicate that As(III) is more easily immobilized than As(V) in the environment, where Fe-Mn binary oxides are available as sorbents and they represent attractive adsorbents for both As(V) and As(III) removal from water and groundwater.

  13. Temperature-Induced Magnetization Reversal in the Mn^{3+}-Doped SmCrO3

    NASA Astrophysics Data System (ADS)

    Wu, Yuying; Xu, Jian; Xia, Zhengcai

    2016-04-01

    The temperature dependence of dc magnetization is investigated for the rare earth chromites SmCrO3 and the doped compound SmCr_{0.9}Mn_{0.1}O3. Different from the magnetization behavior of SmCrO3, temperature-induced magnetization reversals are observed in the Mn^{3+}-doped compound. Moreover, low-temperature isothermal magnetization measurement indicates the magnetic ground state of SmCr_{0.9}Mn_{0.1}O3 to be antiferromagnetic with a spin canting. The field-cooling magnetic hysteresis loop reveals that an exchange bias (EB) phenomenon is present in the sample. The reversal of magnetization and the corresponding EB field is discussed on the basis of the competitive interaction between the antiferromagnetically coupled Cr-rich clusters and Cr-Mn ordered clusters.

  14. Oxidation of Fe-Cr-Al and Fe-Cr-Al-Y Single Crystals

    NASA Astrophysics Data System (ADS)

    Grabke, H. J.; Siegers, M.; Tolpygo, V. K.

    1995-03-01

    Single crystal samples of the alloy Fe-20%Cr-5%Al with and without Y-doping were used to study the "reactive element" (RE) effect, which causes improved oxidation behaviour and formation of a protective Al2O3 layer on this alloy. The oxidation was followed by AES at 10-7 mbar O2 up to about 1000 °C. Most observations were peculiar for this low pO2 environment, but yttrium clearly favors the formation of Al-oxide and stabilizes it also under these conditions, probably by favoring its nucleation. The oxides formed are surface compounds of about monolayer thickness, not clearly related to bulk oxides. Furthermore, the morphologies of oxide scales were investigated by SEM, after oxidation at 1000°C for 100 h at 133 mbar O2. On Fe-Cr-Al the scale is strongly convoluted and tends to spalling, whereas the presence of Y leads to flat scales which are well adherent. This difference is explained by a change in growth mechanism. The tendency for separation of oxide and metal was highest for the samples with low energy metal surface, i.e. (100) and (110), the scale was better adherent on the (111) oriented surface and on the polycrystalline specimen, since in the latter cases the overall energy for scale/metal separation is higher. All observations, from the low and from the high pO2 experiments, are discussed in relation to the approximately ten mechanisms proposed in the literature for explanation of the RE effects.

  15. Effect of on-site Coulomb interaction (U) on the electronic and magnetic properties of Fe2MnSi, Fe2MnAl and Co2MnGe

    NASA Astrophysics Data System (ADS)

    Sharma, Sonu; Pandey, Sudhir K.

    2016-04-01

    The electronic band structures, density of states' plots and magnetic moments of Fe2MnSi, Fe2MnAl, and Co2MnGe are studied by using the first principles calculation. The FM solutions using LSDA without U show the presence of half-metallic ferromagnetic (HFM) ground state in Fe2MnSi, whereas the ground state of Fe2MnAl is found to be metallic. In both compounds the maximum contribution to the total magnetic moment is from the Mn atom, while the Fe atom contributes very less. The electronic structures and magnetic moments of Fe-based compounds are affected significantly by U under around-the-mean-field (AMF) double counting scheme, whereas its effect is very less on Co2MnGe. The magnetic moment of Fe atom in Fe2MnSi (Fe2MnAl) increased by ∼70% (∼75%) and in Mn atom it decreases by ∼50% (∼70%) when the value of U is increased from 1 to 5 eV. Hund's like exchange interactions are increasing in Fe atom while decreasing in Mn atom with increase in U. The Fe and Mn moments are ferromagnetically coupled in Fe2MnSi for all values of U, whereas in Fe2MnAl they are coupled antiferromagnetically below U=2 eV and ferromagnetically above it. Above U=2 eV the metallic ground state of Fe2MnAl changes to semiconducting ground state and the ferromagnetic coupling between Fe and Mn atoms appears to be responsible for this. This shows that the validity of AFM double counting scheme is not robust for the entire range of U in the Fe2MnAl compound.

  16. Mn-Cr systematics in primitive meteorites: Insights from mineral separation and partial dissolution

    NASA Astrophysics Data System (ADS)

    Göpel, Christa; Birck, Jean-Louis; Galy, Albert; Barrat, Jean-Alix; Zanda, Brigitte

    2015-05-01

    Cr isotopic compositions have been measured on carbonaceous chondrites (CC): Tafassasset, Paris, Niger I, NWA 5958, NWA 8157 and Jbilet Winselwan. In bulk samples, the 54Cr/52Cr ratios (expressed as ε54Cr) range from 0.93 to 1.58 ε units. These values are in agreement with values characteristic for distinct petrologic types. Despite this 54Cr heterogeneity, the variability in the 53Cr/52Cr ratios (expressed as ε53Cr) of 0.2 ε units and the Mn/Cr ratios is consistent with the previous finding of an isochron in the Mn-Cr evolution diagram. The Mn/Cr ratio in CC corresponds to variable abundances of high-T condensate formed and separated at the beginning of the solar system, thus the canonical 53Mn/55Mn ratio can be defined. Based on a consistent chronology for U-Pb and Mn-Cr between the earliest objects formed in the solar nebula and the D'Orbigny angrite we define a canonical 53Mn/55Mn ratio and ε53Cri of 6.8 × 10-6 and -0.177, respectively. The internal Mn/Cr systematics in Tafassasset and Paris were studied by two approaches: leaching technique and mineral separation. Despite variable ε54Cr values (up to >30 ε) linear co-variations were found between ε53Cr and Mn/Cr ratio. The mineral separates as well as the leachates of Tafassasset fall on a common isochron indicating that (1) cooling of the Tafassasset's parent body occurred at 4563.5 ± 0.25 Ma, and that (2) 54Cr is decoupled from the other isotopes even though temperatures >900 °C have been reached during metamorphism. In the case of Paris, the leachates form an alignment with a 53Mn/55Mn ratio higher than the canonical value. This alignment is not an isochron but rather a mixing line. Based on leachates from various CM and CI, we propose the occurrence of three distinct Cr reservoirs in meteoritic material: PURE54, HIGH53 and LOW53 characterized by a ε53Cr and ε54Cr of 0 and 25,000, -2.17 and 8, and 0.5 and -151, respectively. PURE54 has already been described and is carried by highly refractory

  17. Quantification of corrosion resistance of a new-class of criticality control materials: thermal-spray coatings of high-boron iron-based amorphous metals - Fe49.7Cr17.7Mn1.9Mo7.4W1.6B15.2C3.8Si2.4

    SciTech Connect

    Farmer, J C; Choi, J S; Shaw, C K; Rebak, R; Day, S D; Lian, T; Hailey, P; Payer, J H; Branagan, D J; Aprigliano, L F

    2007-03-28

    An iron-based amorphous metal, Fe{sub 49.7}Cr{sub 17.7}Mn{sub 1.9}Mo{sub 7.4}W{sub 1.6}B{sub 15.2}C{sub 3.8}Si{sub 2.4} (SAM2X5), with very good corrosion resistance was developed. This material was produced as a melt-spun ribbon, as well as gas atomized powder and a thermal-spray coating. Chromium (Cr), molybdenum (Mo) and tungsten (W) provided corrosion resistance, and boron (B) enabled glass formation. The high boron content of this particular amorphous metal made it an effective neutron absorber, and suitable for criticality control applications. Earlier studies have shown that ingots and melt-spun ribbons of these materials have good passive film stability in these environments. Thermal spray coatings of these materials have now been produced, and have undergone a variety of corrosion testing, including both atmospheric and long-term immersion testing. The modes and rates of corrosion have been determined in the various environments, and are reported here.

  18. Electronic properties of excess Cr at Fe site in FeCr{sub 0.02}Se alloy

    SciTech Connect

    Kumar, Sandeep Singh, Prabhakar P.

    2015-06-24

    We have studied the effect of substitution of transition-metal chromium (Cr) in excess on Fe sub-lattice in the electronic structure of iron-selenide alloys, FeCr{sub 0.02}Se. In our calculations, we used Korringa-Kohn-Rostoker coherent potential approximation method in the atomic sphere approximation (KKR-ASA-CPA). We obtained different band structure of this alloy with respect to the parent FeSe and this may be reason of changing their superconducting properties. We did unpolarized calculations for FeCr{sub 0.02}Se alloy in terms of density of states (DOS) and Fermi surfaces. The local density approximation (LDA) is used in terms of exchange correlation potential.

  19. Monte Carlo simulations of Fe-Cr solid solution

    NASA Astrophysics Data System (ADS)

    Lavrentiev, Mikhail Yu.; Nguyen-Manh, Duc; Drautz, Ralf; Klaver, Peter; Dudarev, Sergei L.

    2007-12-01

    Iron-chromium alloys are characterised by a complex phase diagram, the small negative heat of formation at low Cr concentrations in bcc α-structure of Fe and by the inversion of short-range order parameter. We present Monte Carlo simulations of Fe-Cr alloy based on cluster expansion (CE) approximation for the enthalpy of the system. The set of cluster expansion coefficients is validated versus the DFT results on small clusters in bcc structure. The enthalpy of mixing is negative at small Cr concentrations up to high temperatures. Also, at small concentrations chromium atoms are well separated from each other. Clustering of Cr atoms begins at concentrations of about 10% at 800 K and 20% at 1400 K. Short-range order parameters were calculated and it was confirmed that negative values of the first and second parameters at low Cr concentrations change sign at about 10.5% Cr, in agreement with experiment. We demonstrate that complex ordering reactions in Fe-Cr and its properties may be described by 12 concentration-independent expansion coefficients.

  20. Effects of Cr on the interdiffusion between Ce and Fe-Cr alloys

    NASA Astrophysics Data System (ADS)

    Lo, Wei-Yang; Silva, Nicolas; Wu, Yuedong; Winmann-Smith, Robert; Yang, Yong

    2015-03-01

    Fuel cladding chemical interaction (FCCI) has been a long-standing issue for the metallic fuel with a steel cladding in a sodium-cooled fast reactor, particularly for a high burnup fuel. Although the FCCI has been largely improved by alloying the fuels with Zr or Pd elements, applying a physical diffusion barrier between fuel and cladding, and employing advanced ferritic/martensitic (F/M) claddings, there is a scientific knowledge gap in understanding the behavior of chromium and its effects on the interdiffusion between lanthanides and advanced F/M steels that contain 9-12 wt.% Cr. In this paper, we systematically studied the interdiffusion between cerium and Fe-Cr model alloys with Cr contents of 6, 9 and 12 wt.%. Following the thermal annealing at 560 °C for up to 100 h, detailed microstructural characterizations were performed to determine the interdiffusion microstructures, compositional distributions, diffusion kinetics, and phase structures in the interdiffusion zone. This study unambiguously disclosed that, as the Ce diffuses into Fe-Cr model alloys, Cr segregates and precipitates into Cr-rich σ phase consisted of Fe and Cr instead of forming a ternary phase together with Fe and Ce. The precipitation of those nano-sized σ phase particles at the Ce diffusion front would effectively slow down the interdiffusion.

  1. Long afterglow properties of Zn2GeO4:Mn2+, Cr3+ phosphor

    NASA Astrophysics Data System (ADS)

    Cong, Yan; He, Yangyang; Dong, Bin; Xiao, Yu; Wang, Limei

    2015-04-01

    Zn2GeO4:Mn2+, Cr3+ phosphors were prepared by conventional solid state reaction and the photoluminescence properties were investigated. The Mn2+ activated Zn2GeO4 phosphors exhibited green emission at 533 nm due to the 4T1(4G) → 6A1(6S) transition of Mn2+ ions. With Cr3+ co-doping in Zn2GeO4 host, long afterglow characteristics were found from the same transition of Mn2+. The TL results revealed the presence of same traps in the phosphor, and the doping of Cr3+ ions deepened the VGe traps. The native defect VGe as a hole traps is responsible for the long afterglow emission in Zn2GeO4:Mn2+, Cr3+ phosphor. The possible mechanism of this phosphor has also been discussed.

  2. Paramagnetic properties of Fe-Mn and Fe-V alloys: a DMFT study

    NASA Astrophysics Data System (ADS)

    Belozerov, Alexander S.; Anisimov, Vladimir I.

    2016-09-01

    We calculate magnetic susceptibility of paramagnetic bcc Fe-Mn and Fe-V alloys by two different approaches. The first approach employs the coherent potential approximation (CPA) combined with the dynamical mean-field theory (DMFT). The material-specific Hamiltonians in the Wannier function basis are obtained by density functional theory. In the second approach, we construct supercells modeling the binary alloys and study them using DMFT. Both approaches lead to a qualitative agreement with experimental data. In particular, the decrease of Curie temperature with Mn content and a maximum at about 10 at.% V are well described in units of the Curie temperature of pure iron. In contrast to the Mn impurities, the V ones are found to be antiferromagnetically coupled to Fe atoms. Our calculations for the two-band Anderson–Hubbard model indicate that the antiferromagnetic coupling is responsible for a maximum in the concentration dependence of Curie temperature in Fe-V alloys.

  3. Paramagnetic properties of Fe-Mn and Fe-V alloys: a DMFT study.

    PubMed

    Belozerov, Alexander S; Anisimov, Vladimir I

    2016-09-01

    We calculate magnetic susceptibility of paramagnetic bcc Fe-Mn and Fe-V alloys by two different approaches. The first approach employs the coherent potential approximation (CPA) combined with the dynamical mean-field theory (DMFT). The material-specific Hamiltonians in the Wannier function basis are obtained by density functional theory. In the second approach, we construct supercells modeling the binary alloys and study them using DMFT. Both approaches lead to a qualitative agreement with experimental data. In particular, the decrease of Curie temperature with Mn content and a maximum at about 10 at.% V are well described in units of the Curie temperature of pure iron. In contrast to the Mn impurities, the V ones are found to be antiferromagnetically coupled to Fe atoms. Our calculations for the two-band Anderson-Hubbard model indicate that the antiferromagnetic coupling is responsible for a maximum in the concentration dependence of Curie temperature in Fe-V alloys. PMID:27355416

  4. Paramagnetic properties of Fe-Mn and Fe-V alloys: a DMFT study

    NASA Astrophysics Data System (ADS)

    Belozerov, Alexander S.; Anisimov, Vladimir I.

    2016-09-01

    We calculate magnetic susceptibility of paramagnetic bcc Fe-Mn and Fe-V alloys by two different approaches. The first approach employs the coherent potential approximation (CPA) combined with the dynamical mean-field theory (DMFT). The material-specific Hamiltonians in the Wannier function basis are obtained by density functional theory. In the second approach, we construct supercells modeling the binary alloys and study them using DMFT. Both approaches lead to a qualitative agreement with experimental data. In particular, the decrease of Curie temperature with Mn content and a maximum at about 10 at.% V are well described in units of the Curie temperature of pure iron. In contrast to the Mn impurities, the V ones are found to be antiferromagnetically coupled to Fe atoms. Our calculations for the two-band Anderson-Hubbard model indicate that the antiferromagnetic coupling is responsible for a maximum in the concentration dependence of Curie temperature in Fe-V alloys.

  5. Magnetic properties and atomic ordering of BCC Heusler alloy Fe2MnGa ribbons

    NASA Astrophysics Data System (ADS)

    Xin, Yuepeng; Ma, Yuexing; Luo, Hongzhi; Meng, Fanbin; Liu, Heyan

    2016-05-01

    The electronic structure, atomic disorder and magnetic properties of the Heusler alloy Fe2MnGa have been investigated experimentally and theoretically. BCC Fe2MnGa ribbon samples were prepared. Experimentally, a saturation magnetic moment (3.68 μB at 5 K) much larger than the theoretical value (2.04 μB) has been reported. First-principles calculations indicate that the difference is related to the Fe-Mn disorder between A, B sites, as can also be deduced from the XRD pattern. L21 type Fe2MnGa is a ferrimagnet with antiparallel Fe and Mn spin moments. However, when Fe-Mn disorder occurs, part of Mn moments will be parallel to Fe moments, and the Fe moments also clearly increase simultaneously. All this results in a total moment of 3.74 μB, close to the experimental value.

  6. Optimization studies on a Fe/Cr redox flow battery

    NASA Astrophysics Data System (ADS)

    Lopez-Atalaya, M.; Codina, G.; Perez, J. R.; Vazquez, J. L.; Aldaz, A.

    The performance of a Fe/Cr redox flow battery which operates in bipolar mode is described. The optimization studies on electrolyte composition, temperature and membrane type are presented. These studies have achieved a coulombic efficiency of 97% and an energy efficiency of 73% for an electrolyte composition of 2.3 M HCl + 1.25 M FeCl 2 + 1.25 M CrCl 3, working at 44 °C with a current density of 40 mA/cm 2 and using the Nafion 117 membrane. A maximum discharge power density of 73 mW/cm 2 has been obtained.

  7. Hydrogen-Resistant Fe/Ni/Cr-Base Superalloy

    NASA Technical Reports Server (NTRS)

    Bhat, Biliyar N.; Chen, Po-Shou; Panda, Binayak

    1994-01-01

    Strong Fe/Ni/Cr-base hydrogen- and corrosion-resistant alloy developed. Superalloy exhibits high strength and exceptional resistance to embrittlement by hydrogen. Contains two-phase microstructure consisting of conductivity precipitated phase in conductivity matrix phase. Produced in wrought, weldable form and as castings, alloy maintains high ductility and strength in air and hydrogen. Strength exceeds previously known Fe/Cr/Ni hydrogen-, oxidation-, and corrosion-resistant alloys. Provides higher strength-to-weight ratios for lower weight in applications as storage vessels and pipes that must contain hydrogen.

  8. Ferromagnetic ordering of Cr and Fe doped p-type diamond: An ab initio study

    SciTech Connect

    Benecha, E. M.; Lombardi, E. B.

    2014-02-21

    Ferromagnetic ordering of transition metal dopants in semiconductors holds the prospect of combining the capabilities of semiconductors and magnetic systems in single hybrid devices for spintronic applications. Various semiconductors have so far been considered for spintronic applications, but low Curie temperatures have hindered room temperature applications. We report ab initio DFT calculations on the stability and magnetic properties of Fe and Cr impurities in diamond, and show that their ground state magnetic ordering and stabilization energies depend strongly on the charge state and type of co-doping. We predict that divacancy Cr{sup +2} and substitutional Fe{sup +1} order ferromagnetically in p-type diamond, with magnetic stabilization energies (and magnetic moment per impurity ion) of 16.9 meV (2.5 μ{sub B}) and 33.3 meV (1.0 μ{sub B}), respectively. These magnetic stabilization energies are much larger than what has been achieved in other semiconductors at comparable impurity concentrations, including the archetypal dilute magnetic semiconductor GaAs:Mn. In addition, substitutional Fe{sup +1} exhibits a strong half-metallic character, with the Fermi level crossing bands in only the spin down channel. These results, combined with diamond’s extreme properties, demonstrate that Cr or Fe dopedp-type diamond may successfully be considered in the search for room temperature spintronic materials.

  9. Compositional dependence of antiferromagnetic anisotropy in IrMn/CoFe exchange bias systems

    SciTech Connect

    Aley, N. P.; O'Grady, K.

    2011-04-01

    We report on a study of the effect of Ir content on the loop shift (H{sub EX}) and anisotropy constant (K{sub AF}) in the CoFe/IrMn system. The sample structure investigated was Si/NiCr(5 nm)/Ru(5 nm)/Ir{sub x}Mn{sub 1-x}/CoFe(2 nm)/Ta(3 nm). All samples were produced by sputtering and the Ir and Mn levels were varied using a specially made composite target and deposited at {approx}120 deg. C. The composition of the samples was analyzed using energy dispersive x-ray analysis. K{sub AF} was calculated from thermal activation measurements using the York Protocols. A plateau in H{sub EX} was found for Ir levels between 16- 20.5 at. %. H{sub EX} was found to decrease by 50% on either side of this window. This result is consistent with previous studies where the enhancement of H{sub EX} was attributed to an increase in the atomic ordering of the IrMn alloy. However, K{sub AF} decreases linearly with increasing Ir concentration and does not appear to correlate with the change in H{sub EX}.

  10. Carbon Nanostructures Grown on Fe-Cr-Al Alloy

    NASA Astrophysics Data System (ADS)

    Čaplovičová, Mária; Čaplovič, Ľubomír; Búc, Dalibor; Vinduška, Peter; Janík, Ján

    2010-11-01

    The morphology and nanostructure of carbon nanotubes (CNTs), synthesized directly on Fe-Cr-Al-based alloy substrate using an alcohol catalytic chemical vapour deposition method (ACCVD), were examined by transmission electron microscopy (TEM). The grown CNTs were entangled with chain-like, bamboo-like, and necklace-like morphologies. The CNT morphology was affected by the elemental composition of catalysts and local instability of deposition process. Straight and bended CNTs with bamboo-like nanostructure grew mainly on γ-Fe and Fe3C particles. The synthesis of necklace-like nanostructures was influenced by silicon oxide, and growth of chain-like nanostructures was supported by a catalysts consisting of Fe, Si, oxygen and trace of Cr. Most of nanotubes grew according to base growth mechanism.

  11. The molar volume of cubic garnets in the system SiO2-Al2O3-TiO2-Fe2O3-Cr2O3-FeO-MnO-MgO-CaO-Na2O

    NASA Astrophysics Data System (ADS)

    Hamecher, E. A.; Antoshechkina, P. M.; Ghiorso, M. S.; Asimow, P. D.

    2012-12-01

    Garnet is a critical phase that controls major and trace element partitioning at pressures above ~3 GPa during partial melting of the Earth's upper mantle. A molar volume model is calibrated for cubic garnets (space group Ia3d) in the oxide system listed in the title. This model and a recent calibration of spinel molar volume (Hamecher et al., in press, CMP) will be used in calibration of thermodynamic activity-composition models of garnet and pyroxene solid solutions. The activity and molar volume models will be incorporated into the next generation MELTS (Ghiorso & Sack, 1995, CMP) model, xMELTS. A new garnet volume model calibrated with recent in situ high-P, T diffraction data is crucial for accurately modeling key mineralogical transitions in the mantle, e.g., the spinel-garnet transition and the mantle transition zone. Above 5 GPa a majorite component is an essential part of any thermodynamic model of mantle garnets, which to be useful must accurately predict garnet stability with respect to spinel, pyroxene, perovskites, and melt. Our model system contains nine independent end members: Ca3Al2Si3O12, Mg3Al2Si3O12, Fe2+3Al2Si3O12, Mg3Cr2Si3O12, Mg3Fe3+2Si3O12, Mn3Al2Si3O12, Na2(MgSi2)Si3O12, Mg3(TiMg)Si3O12, and cubic majorite component Mg3(MgSi)Si3O12. An inclusive set of end-member components is formed by linear combinations of these explicit end members. Approximately 950 published X-ray diffraction experiments performed on garnets at ambient and in situ high-P, T conditions are used to calibrate end-member equations of state and an excess volume model for this system. Optimal values of the bulk modulus and its pressure derivative are obtained by analyzing published compression and/or ultrasonic data for the end members for which such studies exist; for other end members, density functional theory results are used. For any cubic garnet in this chemical system, the model molar volume is obtained by adding excess volume terms to a linear combination of the

  12. Interlayer coupling in Fe/Cr/Gd multilayer structures

    SciTech Connect

    Drovosekov, A. B. Kreines, N. M.; Savitsky, A. O.; Kravtsov, E. A.; Blagodatkov, D. V.; Ryabukhina, M. V.; Milyaev, M. A.; Ustinov, V. V.; Pashaev, E. M.; Subbotin, I. A.; Prutskov, G. V.

    2015-06-15

    The effect of the chromium layer thickness on the magnetic state of an [Fe/Cr/Gd/Cr]{sub n} multilayer structure is studied. A series of Fe/Cr/Gd structures with Cr spacer thicknesses of 4–30 Å is studied by SQUID magnetometry and ferromagnetic resonance in the temperature range 4.2–300 K. The obtained experimental results are described in terms of an effective field model, which takes into account a biquadratic contribution to the interlayer coupling energy and a nonuniform magnetization distribution inside the gadolinium layer (which was detected earlier). Depending on the magnetic field and temperature, the following types of magnetic ordering are identified at various chromium layer thicknesses: ferromagnetic, antiferromagnetic, and canted ordering. A comparison of the experimental and calculated curves allowed us to determine the dependence of the bilinear (J{sub 1}) and biquadratic (J{sub 2}) exchange constants on chromium layer thickness t{sub Cr}. Weak oscillations at a period of about 18 Å are detected in the J{sub 1}(t{sub Cr}) dependence in the range 8–30 Å. The interlayer coupling oscillations in the system under study are assumed to be related to the RKKY exchange interaction mechanism via the conduction electrons of Cr.

  13. Magnetic interaction reversal in watermelon nanostructured Cr-doped Fe nanoclusters

    SciTech Connect

    Kaur, Maninder; Qiang, You; Dai, Qilin; Tang, Jinke; Bowden, Mark; Engelhard, Mark; Wu, Yaqiao

    2013-11-11

    Cr-doped core-shell Fe/Fe-oxide nanoclusters (NCs) were synthesized at varied atomic percentages of Cr from 0 at. % to 8 at. %. The low concentrations of Cr (<10 at. %) were selected in order to inhibit the complete conversion of the Fe-oxide shell to Cr{sub 2}O{sub 3} and the Fe core to FeCr alloy. The magnetic interaction in Fe/Fe-oxide NCs (∼25 nm) can be controlled by antiferromagnetic Cr-dopant. We report the origin of σ-FeCr phase at very low Cr concentration (2 at. %) unlike in previous studies, and the interaction reversal from dipolar to exchange interaction in watermelon-like Cr-doped core-shell NCs.

  14. Effects of Cr and Ni on interdiffusion and reaction between U and Fe-Cr-Ni alloys

    NASA Astrophysics Data System (ADS)

    Huang, K.; Park, Y.; Zhou, L.; Coffey, K. R.; Sohn, Y. H.; Sencer, B. H.; Kennedy, J. R.

    2014-08-01

    Metallic U-alloy fuel cladded in steel has been examined for high temperature fast reactor technology wherein the fuel cladding chemical interaction is a challenge that requires a fundamental and quantitative understanding. In order to study the fundamental diffusional interactions between U with Fe and the alloying effect of Cr and Ni, solid-to-solid diffusion couples were assembled between pure U and Fe, Fe-15 wt.%Cr or Fe-15 wt.%Cr-15 wt.%Ni alloy, and annealed at high temperature ranging from 580 to 700 °C. The microstructures and concentration profiles that developed from the diffusion anneal were examined by scanning electron microscopy, and X-ray energy dispersive spectroscopy (XEDS), respectively. Thick U6Fe and thin UFe2 phases were observed to develop with solubilities: up to 2.5 at.% Ni in U6(Fe,Ni), up to 20 at.%Cr in U(Fe, Cr)2, and up to 7 at.%Cr and 14 at.% Ni in U(Fe, Cr, Ni)2. The interdiffusion and reactions in the U vs. Fe and U vs. Fe-Cr-Ni exhibited a similar temperature dependence, while the U vs. Fe-Cr diffusion couples, without the presence of Ni, yielded greater activation energy for the growth of intermetallic phases - lower growth rate at lower temperature but higher growth rate at higher temperature.

  15. Multiferroicity in Mn-deficient Ca3CoMnO6: The consequence of Fe substitution

    NASA Astrophysics Data System (ADS)

    Lin, L.; Xie, Y. L.; Liu, M. F.; Guo, Y. J.; Yan, Z. B.; Liu, J.-M.

    2013-07-01

    We present careful experiments on the multiferroicity in Ca3CoMn0.92O6 by Fe substitution of Mn. It is revealed that a proper Fe substitution modulates the Co/Mn spin order, favoring the ferroelectricity. The multifold interactions between the intra-chain spins and inter-chain spins are analyzed. It is suggested that the Mn deficiency and Fe substitution can break the inter-chain interactions to some extent, resulting in the delicate competition between these mutual interactions. The modulation of the ionic (charge) disorder and spin frustration order is the core physics for improving the ferroelectric performance.

  16. Importance of doping and frustration in itinerant Fe-doped Cr2Al

    DOE PAGESBeta

    Susner, M. A.; Parker, D. S.; Sefat, A. S.

    2015-05-12

    We performed an experimental and theoretical study comparing the effects of Fe-doping of Cr2Al, an antiferromagnet with a N el temperature of 670 K, with known results on Fe-doping of antiferromagnetic bcc Cr. (Cr1-xFex)2Al materials are found to exhibit a rapid suppression of antiferromagnetic order with the presence of Fe, decreasing TN to 170 K for x=0.10. Antiferromagnetic behavior disappears entirely at x≈0.125 after which point increasing paramagnetic behavior is exhibited. Moreover, this is unlike the effects of Fe doping of bcc antiferromagnetic Cr, in which TN gradually decreases followed by the appearance of a ferromagnetic state. Theoretical calculations explainmore » that the Cr2Al-Fe suppression of magnetic order originates from two effects: the first is band narrowing caused by doping of additional electrons from Fe substitution that weakens itinerant magnetism; the second is magnetic frustration of the Cr itinerant moments in Fe-substituted Cr2Al. In pure-phase Cr2Al, the Cr moments have an antiparallel alignment; however, these are destroyed through Fe substitution and the preference of Fe for parallel alignment with Cr. This is unlike bulk Fe-doped Cr alloys in which the Fe anti-aligns with the Cr atoms, and speaks to the importance of the Al atoms in the magnetic structure of Cr2Al and Fe-doped Cr2Al.« less

  17. Hydrogen permeation characteristics of some Fe-Cr-Al alloys

    NASA Astrophysics Data System (ADS)

    Van Deventer, E. H.; Maroni, V. A.

    1983-01-01

    Hydrogen permeation data are reported for two Fe-Cr-Al alloys, Type-405 SS (Cr 14-A1 0.2) and a member of the Fecralloy family of alloys (Cr 16-A1 5). The hydrogen permeability of each alloy (in a partially oxidized condition) was measured over a period of several weeks at randomly selected temperatures (between 150 and 850°C) and upstream H 2 pressures (between 2 and 1.5 × 10 4 Pa). The permeabilities showed considerable scatter with both time and temperature and were 10 2 to 10 3 times lower than those of pure iron, even in strongly reducing environments. The exponent, n, for the relationship between upstream H 2 pressure, P, and permeability, φ, ( φ ~ Pn) was closer to 0.7 than to the expected 0.5, indicating a process limited by surface effects (e.g., surface oxide films) as opposed to bulk material effects. Comparison of these results with prior permeation measurements on other Fe-Cr-Al alloys, on Fe-Cr alloys, and on pure iron shows that the presence of a few weight percent aluminum offers the best prospects for achieving low tritium permeabilities with martensitic and ferritic steels used in fusion-reactor first wall and blanket applications.

  18. Host Atom Diffusion in Ternary Fe-Cr-Al Alloys

    NASA Astrophysics Data System (ADS)

    Rohrberg, Diana; Spitzer, Karl-Heinz; Dörrer, Lars; Kulińska, Anna J.; Borchardt, Günter; Fraczkiewicz, Anna; Markus, Torsten; Jacobs, Michael H. G.; Schmid-Fetzer, Rainer

    2014-01-01

    In the Fe-rich corner of the Fe-Cr-Al ternary phase diagram, both interdiffusion experiments [1048 K to 1573 K (775 °C to 1300 °C)] and 58Fe tracer diffusion experiments [873 K to 1123 K (600 °C to 850 °C)] were performed along the Fe50Cr50-Fe50Al50 section. For the evaluation of the interdiffusion data, a theoretical model was used which directly yields the individual self-diffusion coefficients of the three constituents and the shift of the original interface of the diffusion couple through inverse modeling. The driving chemical potential gradients were derived using a phenomenological Gibbs energy function which was based on thoroughly assessed thermodynamic data. From the comparison of the individual self-diffusivities of Fe as obtained from interdiffusion profiles and independent 58Fe tracer diffusivities, the influence of the B2-A2 order-disorder transition becomes obvious, resulting in a slightly higher activation enthalpy for the bcc-B2 phase and a significantly lower activation entropy for this phase.

  19. Exchange bias in Fe/Cr double superlattices.

    SciTech Connect

    Jiang, J. S.; Felcher, G. P.; Inomata, A.; Goyette, R.; Nelson, C.; Bader, S. D.

    1999-11-30

    Utilizing the oscillatory interlayer exchange coupling in Fe/Cr superlattices, we have constructed ''double superlattice'' structures where a ferromagnetic (F) and an antiferromagnetic (AF) Fe/Cr superlattice are coupled through a Cr spacer. The minor hysteresis loops in the magnetization are shifted from zero field, i.e., the F superlattice is exchange biased by the AF one. The double superlattices are sputter-deposited with (211) epitaxy and possess uniaxial in-plane magnetic anisotropy. The magnitude of the bias field is satisfactorily described by the classic formula for collinear spin structures. The coherent structure and insensitivity to atomic-scale roughness makes it possible to determine the spin distribution by polarized neutron reflectivity, which confirms that the spin structure is collinear. The magnetic reversal behavior of the double superlattices suggests that a realistic model of exchange bias needs to address the process of nucleating local reverse domains.

  20. Aluminum and silicon diffusion in Fe-Cr-Al alloys

    SciTech Connect

    Heesemann, A.; Schmidtke, E.; Faupel, F.; Kolb-Telieps, A.; Kloewer, J.

    1999-02-05

    Foils of Fe-Cr-Al alloys containing about 20 wt% Cr, 5 wt% Al and additions of Si and reactive elements like Ce, La, Y, Hf, Zr or Ti are widely used as a substrate in metal-supported automotive catalytic converters. In the present paper the authors report on measurements of Al and Si diffusion in Fe-Cr-Al alloys. Due to a lack of suitable radiotracers concentration profiles were obtained by means of electron microprobe analysis. In connection with data evaluation they present numerical calculations assessing the accuracy of the Matano analysis and the thin-film solution of Fick`s 2nd law as function of the thickness of the initial diffusant layer. The results are of general interest, particularly for the evaluation of diffusion measurements involving industrial specimens with given geometry.

  1. Fe-Mn nodules of the Mendeleev Ridge, Arctic Ocean

    NASA Astrophysics Data System (ADS)

    Bazilevskaya, E. S.; Skolotnev, S. G.

    2015-10-01

    The results of study of Fe-Mn crusts from the Mendeleev Ridge in the Arctic Ocean sampled with manipulators from a submarine are presented. In almost all the samples, the ore phase is significantly enriched in some valuable trace elements (Ni, Co, Cu, etc.), the contents of which exceed those in ores from the pelagic zones of other oceans. The high ore potential of the Arctic pelagic zone is stated and substantiated.

  2. Electrochemical sensing property of Mn doped Fe3O4 nanoparticles

    NASA Astrophysics Data System (ADS)

    Suresh, R.; Giribabu, K.; Manigandan, R.; Vijayalakshmi, L.; Stephen, A.; Narayanan, V.

    2013-02-01

    The Mn doped Fe3O4 nanoparticles were synthesized by hydrothermal method. The prepared nanoparticles were characterized by X-ray diffraction (XRD) analysis, UV-Visible spectroscopy (UV-Vis) and field emission scanning electron microscopy (FE-SEM). The electrochemical sensing property of pure and Mn doped Fe3O4 nanoparticles were examined using uric acid (UA) as an analyte. The obtained results indicated that the Mn doped Fe3O4 nanoparticles exhibited higher electrocatalytic activity towards UA.

  3. Inhibited Aluminization of an ODS FeCr Alloy

    SciTech Connect

    Vande Put Ep Rouaix, Aurelie; Pint, Bruce A

    2012-01-01

    Aluminide coatings are of interest for fusion energy applications both for compatibility with liquid Pb-Li and to form an alumina layer that acts as a tritium permeation barrier. Oxide dispersion strengthened (ODS) ferritic steels are a structural material candidate for commercial reactor concepts expected to operate above 600 C. Aluminizing was conducted in a laboratory scale chemical vapor deposition reactor using accepted conditions for coating Fe- and Ni-base alloys. However, the measured mass gains on the current batch of ODS Fe-14Cr were extremely low compared to other conventional and ODS alloys. After aluminizing at two different Al activities at 900 C and at 1100 C, characterization showed that the ODS Fe-14Cr specimens formed a dense, primarily AlN layer that prevented Al uptake. This alloy batch contained a higher (> 5000 ppma) N content than the other alloys coated and this is the most likely reason for the inhibited aluminization. Other factors such as the high O content, small ({approx} 140 nm) grain size and Y-Ti oxide nano-clusters in ODS Fe-14Cr also could have contributed to the observed behavior. Examples of typical aluminide coatings formed on conventional and ODS Fe- and Ni-base alloys are shown for comparison.

  4. Ferromagnetic interactions and martensitic transformation in Fe doped Ni-Mn-In shape memory alloys

    SciTech Connect

    Lobo, D. N.; Priolkar, K. R.; Emura, S.; Nigam, A. K.

    2014-11-14

    The structure, magnetic, and martensitic properties of Fe doped Ni-Mn-In magnetic shape memory alloys have been studied by differential scanning calorimetry, magnetization, resistivity, X-ray diffraction (XRD), and EXAFS. While Ni{sub 2}MnIn{sub 1−x}Fe{sub x} (0 ≤ x ≤ 0.6) alloys are ferromagnetic and non martensitic, the martensitic transformation temperature in Ni{sub 2}Mn{sub 1.5}In{sub 1−y}Fe{sub y} and Ni{sub 2}Mn{sub 1.6}In{sub 1−y}Fe{sub y} increases for lower Fe concentrations (y ≤ 0.05) before decreasing sharply for higher Fe concentrations. XRD analysis reveals presence of cubic and tetragonal structural phases in Ni{sub 2}MnIn{sub 1−x}Fe{sub x} at room temperature with tetragonal phase content increasing with Fe doping. Even though the local structure around Mn and Ni in these Fe doped alloys is similar to martensitic Mn rich Ni-Mn-In alloys, presence of ferromagnetic interactions and structural disorder induced by Fe affect Mn-Ni-Mn antiferromagnetic interactions resulting in suppression of martensitic transformation in these Fe doped alloys.

  5. Towards a Superplastic Forming of Fe-Mn-Al Alloys

    SciTech Connect

    Guanabara, Paulo Jr.; Bueno, Levi de O.; Ferreira Batalha, Gilmar

    2011-01-17

    The aim is to study the characteristics of superplasticity, mostly on non qualified materials, such as austenitic steel of the Fe-Mn-Al alloy, which has some of the specific material parameters closely related to microstructural mechanisms. These parameters are used as indicators of material superplastic potentiality. The material was submitted to hot tensile testing, within a temperature range from 600 deg. C to 1000 deg. C and strain-rates varying from 10{sup -6} to 1 s{sup -1}. The strain rate sensitivity parameter (m) and observed maximum elongation until rupture ({epsilon}{sub r}) could be determined and also obtained from the hot tensile test. The experiments stated a possibility of superplastic behaviour in a Fe-Mn-Al alloy within a temperature range from 700 deg. C to 900 deg. C with grain size around 3 {mu}m (ASTM grain size 12) and average strain rate sensitivity of m {approx} 0.54, as well as a maximum elongation at rupture around 600%. The results are based on a more enhanced research from the authors; however, this paper has focused just on the hot tensile test, as further creep tests results are not available herein. There are rare examples of superplasticity study of an austenitic steel Fe-Mn-Al alloy, thus this work showed some possibility of exploring the potential use of such materials in this regime at temperatures {>=}700 deg. C.

  6. Fieldlike spin-orbit torque in ultrathin polycrystalline FeMn films

    NASA Astrophysics Data System (ADS)

    Yang, Yumeng; Xu, Yanjun; Zhang, Xiaoshan; Wang, Ying; Zhang, Shufeng; Li, Run-Wei; Mirshekarloo, Meysam Sharifzadeh; Yao, Kui; Wu, Yihong

    2016-03-01

    Fieldlike spin-orbit torque in FeMn/Pt bilayers with ultrathin polycrystalline FeMn has been characterized through planar Hall effect measurements. A large effective field of 2.05 ×10-5 to 2.44 ×10-5Oe (A-1cm2) is obtained for FeMn in the thickness range of 2-5 nm. The experimental observations can be reasonably accounted for by using a macrospin model under the assumption that the FeMn layer is composed of two spin sublattices with unequal magnetizations. The large effective field corroborates the spin Hall origin of the effective field, considering the much smaller uncompensated net moments in FeMn as compared to NiFe. The effective absorption of spin current by FeMn is further confirmed by the fact that spin current generated by Pt in NiFe/FeMn/Pt trilayers can only travel through the FeMn layer with a thickness of 1-4 nm. By quantifying the fieldlike effective field induced in NiFe, a spin diffusion length of 2 nm is estimated in FeMn, consistent with values reported in the literature by ferromagnetic resonance and spin-pumping experiments.

  7. Mn-Cr Systematics in Sphalerites and Niningerites From Qingzhen and Yamato69001: Implications Regarding Their Formation Histories

    NASA Astrophysics Data System (ADS)

    El Goresy, A.; Wadhwa, M.; Zinner, E. K.; Nagel, H.-J.; Janicke, J.; Crozaz, G.

    1992-07-01

    Recent Cr isotopic measurements of sphalerites and alabandites in three EL3 chondrites MAC88136, MAC88180, and MAC88184 and of sphalerites in the EH4 chondrite Indarch (El Goresy et al., 1992) revealed ^53Cr excesses (^53Cr*), resulting from the in situ decay of ^53Mn (tau(sub)1/2=3.7 Ma), in most grains analysed. However, the initial ^53Mn/^55Mn ratios calculated for these grains were quite variable, and it was concluded that redistribution of ^53Cr* by diffusional processes was the most likely cause for these variations. In a continuation of the previous work (El Goresy et al., 1992), we report new mineral-chemical and Cr-isotopic data for two EH3 chondrites, Qingzhen and Yamato 69001. The distribution of Fe, Mg, and Mn in niningerites and sphalerites occurring in individual sulfide assemblages was determined by electron microprobe analysis. Among the meteorites of the EH3 subgroup, Qingzhen and Yamato 69001 are unique in that niningerites in both meteorites display normal as well as reversed zoning, indicating complex thermal histories (Ehlers and El Goresy, 1988; Lin et al., 1989; Lin, 1991; Nagel, 1991). Niningerites have different MnS contents (9.2-32.6 mol% MnS in Qingzhen vs. 4.2- 6.3 mol% MnS in Yamato 69001), as do the sphalerites (4.0-9.2 mol% MnS in Qingzhen vs. 2.0-3.5 mol% in Yamato 69001). Sphalerites in both meteorites are normally zoned, with 46.0-49.8 mol% FeS in sphalerites from Qingzhen, and 42.3-49.7 mol% FeS in sphalerites from Yamato 69001. The spatial distributions of Fe and Mg in niningerites and of Fe and Mn in sphalerites indicate complex processes that may have occurred before accretion and/or during later metamorphic events in the parent body (El Goresy and Ehlers, 1989; Lin, 1991; Nagel, 1991). Ion microprobe measurements of 6 sphalerites and 3 niningerites in Qingzhen and of 3 sphalerites and 2 niningerites in Yamato 69001 showed that ^55Mn/^52Cr ratios in these sulfide phases are significantly lower than in sphalerites and

  8. Preparation, structural and magnetic characterization of DyCrMnO{sub 5}

    SciTech Connect

    Martinez-Lope, M.J.; Retuerto, M. Garcia-Hernandez, M.; Alonso, J.A.

    2009-03-15

    The title compound has been first synthesized by a citrate technique followed by thermal treatments under moderate oxygen pressure conditions, and characterized by X-ray and neutron powder diffraction (NPD) and magnetization measurements. The crystal structure of DyCrMnO{sub 5} has been refined from NPD data in the space group Pbam; a=7.2617(6) A, b=8.5161(6) A, and c=5.7126(5) A at 295 K. This oxide is isostructural with RMn{sub 2}O{sub 5} oxides (R=rare earths) and it contains infinite chains of (Cr, Mn){sup 4+}O{sub 6} octahedra-sharing edges, linked together by (Mn, Cr){sup 3+}O{sub 5} pyramids and DyO{sub 8} units. The high degree of antisite disordering exhibited by DyCrMnO{sub 5} is noteworthy. The octahedral positions are occupied by roughly 50% of Mn and Cr cations, and the pyramidal groups contain two thirds of Mn and one third of Cr cations. We assume that Mn and Cr cations at the octahedral positions exhibit a tetravalent oxidation state, whereas the metals at the pyramidal positions are trivalent, in order to preserve the electroneutrality of this oxide. The susceptibility vs temperature curve of DyCrMnO{sub 5} does not suggest the establishment of a long-range magnetic structure even at low temperatures; the NPD technique does not provide any signal of magnetic ordering, since the reflections do not show any magnetic contribution. - Graphical abstract: DyCrMnO{sub 5} is isostructural with DyMn{sub 2}O{sub 5}, belonging to the Pbam space group. The crystal structure contains infinite chains of edge-sharing Mn{sup 4+}O{sub 6} octahedra, interconnected by dimer units of Cr{sup 3+}O{sub 5} square pyramids. The low-temperature neutron powder diffraction (NPD) patterns do not show any magnetic contribution, indicating that a full long-range magnetic ordering is not established down to low temperature, although the Dy{sup 3+} magnetic moments are susceptible to be polarized by an external magnetic field at the lowest temperature of 5 K.

  9. Corrosion Resistance of Amorphous Fe49.7Cr17.7Mn1.9Mo7.4W1.6B15.2C3.8Si2.4 coating - a new criticality-controlled material

    SciTech Connect

    Farmer, J C; Choi, J S; Saw, C K; Rebak, R; Day, S D; Lian, T; Hailey, P; Payer, J H; Branagan, D J; Aprigliano, L F

    2007-03-28

    An iron-based amorphous metal with good corrosion resistance and a high absorption cross-section for thermal neutrons has been developed and is reported here. This amorphous alloy has the approximate formula Fe{sub 49.7}Cr{sub 17.7}Mn{sub 1.9}Mo{sub 7.4}W{sub 1.6}B{sub 15.2}C{sub 3.8}Si{sub 2.4} and is known as SAM2X5. Chromium (Cr), molybdenum (Mo) and tungsten (W) were added to provide corrosion resistance, while boron (B) was added to promote glass formation and the absorption of thermal neutrons. Since this amorphous metal has a higher boron content than conventional borated stainless steels, it provides the nuclear engineer with design advantages for criticality control structures with enhanced safety. While melt-spun ribbons with limited practical applications were initially produced, large quantities (several tons) of gas atomized powder have now been produced on an industrial scale, and applied as thermal-spray coatings on prototypical half-scale spent nuclear fuel containers and neutron-absorbing baskets. These prototypes and other SAM2X5 samples have undergone a variety of corrosion testing, including both salt-fog and long-term immersion testing. Modes and rates of corrosion have been determined in various relevant environments, and are reported here. While these coatings have less corrosion resistance than melt-spun ribbons and optimized coatings produced in the laboratory, substantial corrosion resistance has been achieved.

  10. Long-Term Corrosion Tests of Prototypical SAM2X5 (Fe49.7Cr17.7Mn1.9Mo7.4W1.6B15.2C3.8Si2.4) Coatings

    SciTech Connect

    Farmer, J C; Choi, J S; Saw, C K; Rebak, R H; Day, S D; Lian, T; Hailey, P D; Payer, J H; Branagan, D J; Aprigliano, L F

    2007-05-10

    An iron-based amorphous metal with good corrosion resistance and a high absorption cross-section for thermal neutrons has been developed and is reported here. This amorphous alloy has the approximate formula Fe{sub 49.7}Cr{sub 17.7}Mn{sub 1.9}Mo{sub 7.4}W{sub 1.6}B{sub 15.2}C{sub 3.8}Si{sub 2.4} and is known as SAM2X5. Chromium (Cr), molybdenum (Mo) and tungsten (W) were added to provide corrosion resistance, while boron (B) was added to promote glass formation and the absorption of thermal neutrons. Since this amorphous metal has a higher boron content than conventional borated stainless steels, it provides the nuclear engineer with design advantages for criticality control structures with enhanced safety. While melt-spun ribbons with limited practical applications were initially produced, large quantities (several tons) of gas atomized powder have now been produced on an industrial scale, and applied as thermal-spray coatings on prototypical half-scale spent nuclear fuel containers and neutron-absorbing baskets. These prototypes and other SAM2X5 samples have undergone a variety of corrosion testing, including both salt-fog and long-term immersion testing. The modes and rates of corrosion have been determined in the various environments, and are reported here. While these coatings have less corrosion resistance than melt-spun ribbons and optimized coatings produced in the laboratory, substantial corrosion resistance has been achieved.

  11. The Mn-Fe negative correlation in olivines in ALHA 77257 ureilite

    NASA Technical Reports Server (NTRS)

    Miyamoto, M.; Furuta, T.; Fujii, N.; Mckay, D. S.; Lofgren, G. E.; Duke, M. B.

    1993-01-01

    An electron probe microanalyzer is used to measure the Mn, Fe, and oxygen zoning profiles of olivines in the ALHA 77257 ureilite. This is done to study the effects of reduction on the Mn-Fe value, as ureilite olivines exhibit thin reduced rims. Since the Mn content gradually increases toward the rim of ureilite olivines, while the Fa (= 100 x Fe/(Mg + Fe), mol percent) component decreases, the Mn-Fe content of olivine is likely related to redox conditions. The results of melting experiments suggest that the Mn-Fe positive correlation is related to temperature and that the negative correlation of Mn-Fe in olivine and low-Ca pyroxene is related to reduction.

  12. Wear and Corrosion Behaviors of FeCrBSiNbW Amorphous/Nanocrystalline Coating Prepared by Arc Spraying Process

    NASA Astrophysics Data System (ADS)

    Cheng, J. B.; Wang, Z. H.; Xu, B. S.

    2012-09-01

    FeCrBSiNbW coatings were synthesized using robotically manipulating twin wires arc spraying system. The microstructure and mechanical properties of the coating were characterized. The coating has a laminated structure, and its porosity is 2.8%. The microstructure of the coating consists of amorphous and α-(Fe,Cr) nanocrystalline. The nanocrystalline grains with a scale of 20-75 nm are homogenously dispersed in amorphous matrix. The results show that FeCrBSiNbW coating has excellent wear and corrosion resistance. The wear resistance of the coating is about 4.6 times higher than that of 3Cr13 coating under the same testing condition. In 3.5% NaCl aqueous solution, the amorphous/nanocrystalline coating presents lower I corr values in polarization curves and higher fitted R t values in EIS plots than that of the 0Cr18Ni9 coating (chemical composition by EDAX analysis: C1.07-O12.38-Si0.49-Cr15.18-Mn0.89-Ni7.09-Fe62.24 at.%).

  13. The Mn-53-Cr-53 System in CAIs: An Update

    NASA Technical Reports Server (NTRS)

    Papanastassiou, D. A.; Wasserburg, G. J.; Bogdanovski, O.

    2005-01-01

    High precision techniques have been developed for the measurement of Cr isotopes on the Triton mass spectrometer, at JPL. It is clear that multiple Faraday cup, simultaneous ion collection may reduce the uncertainty of isotope ratios relative to single Faraday cup ion collection, by the elimination of uncertainties from ion beam instabilities (since ion beam intensities for single cup collection are interpolated in time to calculate isotope ratios), and due to a greatly increased data collection duty cycle, for simultaneous ion collection. Efforts to measure Cr by simultaneous ion collection have not been successful in the past. Determinations on Cr-50-54Cr, by simultaneous ion collection on the Finnigan/ MAT 262 instrument at Caltech, resulted in large variations in extrinsic precision, for normal Cr, of up to 1% in Cr-53/Cr-52 (data corrected for mass fractionation, using Cr-50/Cr-52).

  14. Influence of Partial Pressure of Sulfur and Oxygen on Distribution of Fe and Mn between Liquid Fe-Mn Oxysulfide and Molten Slag

    NASA Astrophysics Data System (ADS)

    Kim, Sun-Joong; Shibata, Hiroyuki; Takekawa, Jun; Kitamura, Shin-Ya; Yamaguchi, Katsunori; Kang, Youn-Bae

    2012-10-01

    The authors proposed an innovative process for recovering Mn from steelmaking slag. The process starts with the sulfurization of steelmaking slag to separate P from Mn by the formation of a liquid sulfide phase (matte). Then, the obtained matte is weakly oxidized to make a Mn-rich oxide phase without P. High-purity Fe-Mn alloys can therefore be produced by the reduction of the Mn-rich oxide phase. However, to the authors' knowledge, the sulfurization of molten slag containing P and Mn has not been sufficiently investigated. It was recently found that P was not distributed to the matte in equilibrium with the molten slag. To gain knowledge of the process's development, it is important to investigate the influence of the partial pressures of sulfur and oxygen on the equilibrium distribution of Mn and Fe between the matte and the molten slag. In the current work, a mineralogical microstructure analysis of the matte revealed that the existence of the oxysulfide and metal phases was dependent on the partial pressure of sulfur and oxygen. The Mn content of the matte increased with partial pressure of sulfur while the O content of the matte decreased. In contrast, the ratio of Mn/Fe in the matte was constant when the metal phase of the matte was observed at a log P_{{{{O}}2 }} below -11. These results also corresponded to the relationship between the activity coefficient ratio of MnS/FeS and the mole fraction of MnS/FeS in the matte. The γ MnS/ γ FeS value decreased exponentially as the mole fraction of MnS/FeS increased.

  15. Vibrational entropy of spinodal decomposition in FeCr

    SciTech Connect

    Swan-Wood, T.L.; Delaire, O.; Fultz, B.

    2005-07-01

    Inelastic neutron-scattering spectra were measured on stoichiometric Fe{sub 0.50}Cr{sub 0.50} prepared as a body-centered-cubic (bcc) solid solution, and after increasing amounts of chemical unmixing on the bcc lattice induced by annealing the solid solution at 773 K. These spectra were reduced by a conventional procedure to a neutron-weighted vibrational density of states. Moessbauer spectrometry was used to characterize the extent of decomposition after annealing. A neutron-weight correction was performed, using results from the Moessbauer spectra and recent data on inelastic nuclear resonant scattering from {sup 57}Fe-Cr. The vibrational entropy of decomposition was found to be -0.17{+-}0.01k{sub B}/atom, nearly equal to the change in configurational entropy after spinodal decomposition. Effects of vibrational entropy on the thermodynamics of unmixing are analyzed, showing a large effect on the free energy with the formation of Cr-rich zones, and a large effect on the critical temperature for spinodal decomposition for equiatomic Fe{sub 0.50}Cr{sub 0.50}.

  16. Synthesis and characterization of perovskite-type Sr{sub x}Y{sub 1−x}FeO{sub 3−δ} (0.63≤x<1.0) and Sr{sub 0.75}Y{sub 0.25}Fe{sub 1−y}M{sub y}O{sub 3−δ} (M=Cr, Mn, Ni), (y=0.2, 0.33, 0.5)

    SciTech Connect

    Biendicho, J.J.; Shafeie, S.; Frenck, L.; Gavrilova, D.; Böhme, S.; Bettanini, A.M.; Svedlindh, P.; Hull, S.; Zhao, Z.; Istomin, S.Ya.; Grins, J.; Svensson, G.

    2013-04-15

    Oxygen-deficient ferrates with the cubic perovskite structure Sr{sub x}Y{sub 1−x}FeO{sub 3−δ} were prepared in air (0.71≤x≤0.91) as well as in N{sub 2} (x=0.75 and 0.79) at 1573 K. The oxygen content of the compounds prepared in air increases with increasing strontium content from 3−δ=2.79(2) for x=0.75 to 3−δ=2.83(2) for x=0.91. Refinement of the crystal structure of Sr{sub 0.75}Y{sub 0.25}FeO{sub 2.79} using TOF neutron powder diffraction (NPD) data shows high anisotropic atomic displacement parameter (ADP) for the oxygen atom resulting from a substantial cation and anion disorder. Electron diffraction (ED) and high-resolution electron microscopy (HREM) studies of Sr{sub 0.75}Y{sub 0.25}FeO{sub 2.79} reveal a modulation along 〈1 0 0〉{sub p} with G± ∼0.4〈1 0 0〉{sub p} indicating a local ordering of oxygen vacancies. Magnetic susceptibility measurements at 5–390 K show spin-glass behaviour with dominating antiferromagnetic coupling between the magnetic moments of Fe cations. Among the studied compositions, Sr{sub 0.75}Y{sub 0.25}FeO{sub 2.79} shows the lowest thermal expansion coefficient (TEC) of 10.5 ppm/K in air at 298–673 K. At 773–1173 K TEC increases up to 17.2 ppm/K due to substantial reduction of oxygen content. The latter also results in a dramatic decrease of the electrical conductivity in air above 673 K. Partial substitution of Fe by Cr, Mn and Ni according to the formula Sr{sub 0.75}Y{sub 0.25}Fe{sub 1−y}M{sub y}O{sub 3−δ} (y=0.2, 0.33, 0.5) leads to cubic perovskites for all substituents with y=0.2. Their TECs are higher in comparison with un-doped Sr{sub 0.75}Y{sub 0.25}FeO{sub 2.79}. Only M=Ni has increased electrical conductivity compared to un-doped Sr{sub 0.75}Y{sub 0.25}FeO{sub 2.79}. - Graphical abstract: Oxygen-deficient ferrates with the cubic perovskite structure Sr{sub x}Y{sub 1−x}FeO{sub 3−δ} were prepared both in air (0.71≤x≤0.91) and N{sub 2} (x=0.75 and 0.79) at 1573 K. Refinement of the

  17. Mixing antiferromagnets to tune NiFe-[IrMn/FeMn] interfacial spin-glasses, grains thermal stability, and related exchange bias properties

    NASA Astrophysics Data System (ADS)

    Akmaldinov, K.; Ducruet, C.; Portemont, C.; Joumard, I.; Prejbeanu, I. L.; Dieny, B.; Baltz, V.

    2014-05-01

    Spintronics devices and in particular thermally assisted magnetic random access memories require a wide range of ferromagnetic/antiferromagnetic (F/AF) exchange bias (EB) properties and subsequently of AF materials to fulfil diverse functionality requirements for the reference and storage. For the reference layer, large EB energies and high blocking temperature (TB) are required. In contrast, for the storage layer, mostly moderate TB are needed. One of the present issues is to find a storage layer with properties intermediate between those of IrMn and FeMn and in particular: (i) with a TB larger than FeMn for better stability at rest-T but lower than IrMn to reduce power consumption at write-T and (ii) with improved magnetic interfacial quality, i.e., with reduced interfacial glassy character for lower properties dispersions. To address this issue, the EB properties of F/AF based stacks were studied for various mixed [IrMn/FeMn] AFs. In addition to EB loop shifts, the F/AF magnetic interfacial qualities and the AF grains thermal stability are probed via measurements of the low- and high-temperature contributions to the TB distributions, respectively. A tuning of the above three parameters is observed when evolving from IrMn to FeMn via [IrMn/FeMn] repetitions.

  18. Mixing antiferromagnets to tune NiFe-[IrMn/FeMn] interfacial spin-glasses, grains thermal stability, and related exchange bias properties

    SciTech Connect

    Akmaldinov, K.; Ducruet, C.; Portemont, C.; Joumard, I.; Prejbeanu, I. L.; Dieny, B.; Baltz, V.

    2014-05-07

    Spintronics devices and in particular thermally assisted magnetic random access memories require a wide range of ferromagnetic/antiferromagnetic (F/AF) exchange bias (EB) properties and subsequently of AF materials to fulfil diverse functionality requirements for the reference and storage. For the reference layer, large EB energies and high blocking temperature (T{sub B}) are required. In contrast, for the storage layer, mostly moderate T{sub B} are needed. One of the present issues is to find a storage layer with properties intermediate between those of IrMn and FeMn and in particular: (i) with a T{sub B} larger than FeMn for better stability at rest-T but lower than IrMn to reduce power consumption at write-T and (ii) with improved magnetic interfacial quality, i.e., with reduced interfacial glassy character for lower properties dispersions. To address this issue, the EB properties of F/AF based stacks were studied for various mixed [IrMn/FeMn] AFs. In addition to EB loop shifts, the F/AF magnetic interfacial qualities and the AF grains thermal stability are probed via measurements of the low- and high-temperature contributions to the T{sub B} distributions, respectively. A tuning of the above three parameters is observed when evolving from IrMn to FeMn via [IrMn/FeMn] repetitions.

  19. Origin of concretionary Mn-Fe-oxides in stream sediments of Maine, U.S.A.

    USGS Publications Warehouse

    Nowlan, G.A.; McHugh, J.B.; Hessin, T.D.

    1983-01-01

    Studies of stream and sediment-pore waters largely explain the genesis of concretionary Mn-Fe-oxides in Maine. Waters of two small streams near Jackman, Maine, were studied in terms of pH, Eh, dissolved oxygen, dissolved organic carbon, dissolved Mn, total dissolved Fe, and ferrous and ferric Fe. Pyrite Creek has profuse concretions and coatings of Mn-Fe-oxides, whereas West Pyrite Creek has only sparse Mn-Fe-oxide stains. Pyrite Creek drains boggy terrain and West Pyrite Creek drains well-drained terrain. In West Pyrite Creek, stream and subjacent pore waters have chemical characteristics that do not differ greatly. However, dissolved Mn, ferrous Fe, dissolved oxygen, and in situ Eh measurements show that a steep Eh gradient exists between stream and subjacent pore waters of Pyrite Creek. The steep Eh gradient is manifested by the common zonation of coatings and stains on rocks in stream sediment. The bottom zone has no deposition of oxides, the middle zone is red and consists mostly of Fe-oxides, and the upper zone is black or dark-brown and consists of Mn-oxides with varying amounts of Fe-oxides. The zonation agrees with theoretical predictions of oxide stability as one moves from a reducing to an oxidizing environment. At locations where concretionary Mn-Fe-oxides form, pore waters are depleted of oxygen because of abundant decaying organic material in the stream sediment. The pore waters are charged with dissolved Mn and Fe because mechanically deposited Mn-Fe-oxides are remobilized due to the low-Eh conditions. Groundwaters also contribute dissolved Mn and Fe. Stream waters, on the other hand, are oxygenated and the high-Eh conditions result in low concentrations of dissolved Mn and Fe in stream waters because of the insolubility of Mn-Fe-oxides in high-Eh environments. Therefore, concretionary Mn-Fe-oxides form at the interface between pore and stream waters because Mn- and Fe-rich pore waters, which are undersaturated with respect to Mn-Fe-oxides, mix with

  20. Close correlation between magnetic properties and the soft phonon mode of the structural transition in BaFe>2mn>As>2mn> and SrFe>2mn>As>2mn>

    SciTech Connect

    Parshall, D.; Pintschovius, L.; Niedziela, Jennifer L.; Castellan, J. -P.; Lamago, D.; Mittal, R.; Wolf, Th.; Reznik, Dmitry

    2015-04-27

    Parent compounds of Fe-based superconductors undergo a structural phase transition from a tetragonal to an orthorhombic structure. We investigated the temperature dependence of the frequencies of TA phonons that extrapolate to the shear vibrational mode at the zone center, which corresponds to the orthorhombic deformation of the crystal structure at low temperatures in BaFe>2mn>As>2mn> and SrFe>2mn>As>2mn>. We found that acoustic phonons at small wave vectors soften gradually towards the transition from high temperatures, tracking the increase of the size of slowly fluctuating magnetic domains. On cooling below the transition to base temperature the phonons harden, following the square of the magnetic moment (which we find is proportional to the anisotropy gap). Finally, our results provide evidence for close correlation between magnetic and phonon properties in Fe-based superconductors.

  1. Luminescence spectroscopy of Cr3+ and Mn2+ in spodumene crystals

    NASA Astrophysics Data System (ADS)

    Walker, G.; El Jaer, A.; Sherlock, R.; Glynn, Thomas J.; Czaja, M.; Mazurak, Zbigniew

    1997-11-01

    Luminescence emission and excitation spectra of a number of natural spodumene crystals have been measured at temperatures down to 12K. Both Cr3+ and Mn2+ centers were identified: Mn2+ is shown to be mainly in Li-sites rather than Al-sites and gives rise to abroad emission centered at 600 nm. In most spodumenes Cr3+ R-line emission with phonon sideband is observed at temperatures below 100K. In green hiddenite crystals Cr3+ emission is dominant at room temperature where the R-lines are superimposed on a broad-band emission. Calculation of the crystal-field splitting of the Cr3+ energy levels has been carried out assuming a C2v pseudo-symmetry for the Al-sites. In the more Mn- rich crystals multiple R1 lines are seen at temperatures below about 40K which are possibly associated with adjacent point defects due to charge compensation effects.

  2. High-Performance Corrosion-Resistant Iron-Based Amorphous Metals - The Effects of Composition, Structure and Environment: Fe49.7Cr17.7Mn1.9Mo7.4W1.6B15.2C3.8Si2.4

    SciTech Connect

    Farmer, J; Haslam, J; Day, S; Lian, T; Saw, C; Hailey, P; Choi, J; Yang, N; Bayles, R; Aprigliano, L; Payer, J; Perepezko, J; Hildal, K; Lavernia, E; Ajdelsztajn, L; Branagan, D J; Beardsely, M B

    2006-10-20

    Several Fe-based amorphous metal formulations have been identified that appear to have corrosion resistance comparable to (or better than) that of Ni-based Alloy C-22 (UNS No. N06022), based on measurements of breakdown potential and corrosion rate in seawater. Both chromium (Cr) and molybdenum (Mo) provide corrosion resistance, boron (B) enables glass formation, and rare earths such as yttrium (Y) lower critical cooling rate (CCR). SAM2X5 (Fe{sub 49.7}Cr{sub 17.7}Mn{sub 1.9}Mo{sub 7.4}W{sub 1.6}B{sub 15.2}C{sub 3.8}Si{sub 2.4}) has no yttrium, and is characterized by relatively high critical cooling rates of approximately 600 Kelvin per second. Data for the SAM2X5 formulation is reported here. In contrast to yttrium-containing iron-based amorphous metals, SAM2X5 can be readily gas atomized to produce spherical powders which enable more facile thermal spray deposition. The reference material, nickel-based Alloy C-22, is an outstanding corrosion-resistant engineering material. Even so, crevice corrosion has been observed with C-22 in hot sodium chloride environments without buffer or inhibitor. SAM2X5 also experiences crevice corrosion under sufficiently harsh conditions. Both Alloy C-22 and Type 316L stainless lose their resistance to corrosion during thermal spraying, due to the formation of deleterious intermetallic phases which depletes the matrix of key alloy elements, whereas SAM2X5 can be applied as coatings with the same corrosion resistance as a fully-dense completely amorphous melt-spun ribbon, provided that its amorphous nature is preserved during thermal spraying. The hardness of Type 316L Stainless Steel is approximately 150 VHN, that of Alloy C-22 is approximately 250 VHN, and that of HVOF SAM2X5 ranges from 1100-1300 VHN [MRS12-13]. Such hardness makes these materials particularly attractive for applications where corrosion-erosion and wear are also issues. Since SAM2X5 has high boron content, it can absorb neutrons efficiently, and may therefore find

  3. The structure of rapidly solidified Al- Fe- Cr alloys

    NASA Astrophysics Data System (ADS)

    Yearim, R.; Shechtman, D.

    1982-11-01

    Four aluminum alloys, designed for use at elevated temperatures, were studied. The alloys were supersaturated with iron and chromium, and one of them contained small amounts of Ti, V, and Zr. The starting materials were alloy powders made by the RSR (Rapid Solidification Rate) centrifugal atomization process. Extrusion bars were made from the four powders. The as-extruded microstructure and the microstructure of the alloys after annealing at 482 °C were investigated by optical and transmission electron microscopy and by X-ray diffraction. The microstructure consists of equiaxed grains of aluminum matrix and two types of precipitates, namely, Al3(Fe ,Cr) and a metastable phase, Al6(Fe,Cr). The precipitates were different in their shape, size, distribution, and location within the grains.

  4. Thermodynamics of Cr2O3, FeCr2O4, ZnCr2O4 and CoCr2O4

    SciTech Connect

    Ziemniak SE, Anovitz LM, Castelli RA, Porter WD

    2007-01-09

    High temperature heat capacity measurements were obtained for Cr{sub 2}O{sub 3}, FeCr{sub 2}O{sub 4}, ZnCr{sub 2}O{sub 4} and CoCr{sub 2}O{sub 4} using a differential scanning calorimeter. These data were combined with previously-available, overlapping heat capacity data at temperatures up to 400 K and fitted to 5-parameter Maier-Kelley C{sub p}(T) equations. Expressions for molar entropy were then derived by suitable integration of the Maier-Kelley equations in combination with recent S{sup o}(298) evaluations. Finally, a database of high temperature equilibrium measurements on the formation of these oxides was constructed and critically evaluated. Gibbs energies of Cr{sub 2}O{sub 3}, FeCr{sub 2}O{sub 4} and CoCr{sub 2}O{sub 4} were referenced by averaging the most reliable results at reference temperatures of 1100, 1400 and 1373 K, respectively, while Gibbs energies for ZnCr{sub 2}O{sub 4} were referenced to the results of Jacob [Thermochim. Acta 15 (1976) 79-87] at 1100 K. Thermodynamic extrapolations from the high temperature reference points to 298.15 K by application of the heat capacity correlations gave {Delta}{sub f}G{sup o}(298) = -1049.96, -1339.40, -1428.35 and -1326.75 kJ mol{sup -1} for Cr{sub 2}O{sub 3}, FeCr{sub 2}O{sub 4}, ZnCr{sub 2}O{sub 4} and CoCr{sub 2}O{sub 4}, respectively.

  5. Early solar system timescales according to 53Mn- 53Cr systematics

    NASA Astrophysics Data System (ADS)

    Lugmair, G. W.; Shukolyukov, A.

    1998-08-01

    We present results of a study of the 53Mn- 53Cr systematics in various solar system objects: angrites, eucrites, chondrites, diogenites, pallasites, the Earth and the Moon, and SNC meteorites. The primary goal of this study was to explore the capabilities of the 53Mn- 53Cr isotope system as a chronometer and as a tracer for events in the early solar system, to obtain chronological information on different classes of meteorites, and to investigate the indigenous distribution of 53Mn in the late nebula. These studies have shown that all meteorite groups investigated so far have excess 53Cr relative to the terrestrial value. A lunar sample exhibits 53Cr/ 52Cr ratios which are the same as the terrestrial normal. The angrites, several eucrites, and the pallasites show clear evidence for the existence of life 53Mn during their formation while other meteorites were isotopically equilibrated after essentially all 53Mn had decayed. A well defined whole-rock 53Mn- 53Cr isochron for the HED (Howardite-Eucrite-Diogenite) parent body was obtained. The isochron indicates that this planetesimal was essentially totally molten and differentiated ˜7 Ma before the angrites crystallized. Using the absolute age of the angrites as a time marker this event has occurred 4565 Ma ago, within present uncertainties at the same time when high temperature meteorite inclusions (CAI) were formed in the nebula. The first basalts were deposited onto its surface within less than 3 Ma. The bulk Mn/Cr ratios of the HED parent body (presumably Vesta), the angrites, and the pallasites are consistent with a chondritic Mn/Cr ratio. The results from the SCN meteorites show that their 53Cr excesses are less than half of those found in the other meteorites. Thus, the characteristic 53Cr/ 52Cr ratio of Mars (assuming SNCs originate from this planet) are intermediate between that of the earth-moon system and those of the other meteorites. When these 53Cr excesses are plotted as a function of the heliocentric

  6. Magnetic properties and thermal stability of MnBi/NdFeB hybrid bonded magnets

    SciTech Connect

    Cao, S.; Yue, M.; Yang, Y. X.; Zhang, D. T.; Liu, W. Q.; Zhang, J. X.; Guo, Z. H.; Li, W.

    2011-04-01

    Magnetic properties and thermal stability were investigated for the MnBi/NdFeB (MnBi = 0, 20, 40, 60, 80, and 100 wt.%) bonded hybrid magnets prepared by spark plasma sintering (SPS) technique. Effect of MnBi content on the magnetic properties of the hybrid magnets was studied. With increasing MnBi content, the coercivity of the MnBi/NdFeB hybrid magnets increases rapidly, while the remanence and maximum energy product drops simultaneously. Thermal stability measurement on MnBi magnet, NdFeB magnet, and the hybrid magnet with 20 wt.% MnBi indicates that both the NdFeB magnet and the MnBi/NdFeB hybrid magnet have a negative temperature coefficient of coercivity, while the MnBi magnet has a positive one. The (BH){sub max} of the MnBi/NdFeB magnet (MnBi = 20 wt.%) is 5.71 MGOe at 423 K, which is much higher than 3.67 MGOe of the NdFeB magnet, indicating a remarkable improvement of thermal stability.

  7. Effects of Cr and B Contents on Volume Fraction of (Cr,Fe)2B and Hardness in Fe-Based Alloys Used for Powder Injection Molding

    NASA Astrophysics Data System (ADS)

    Do, Jeonghyeon; Lee, Hyuk-Joong; Jeon, Changwoo; Ha, Dae Jin; Kim, Choongnyun Paul; Lee, Byeong-Joo; Lee, Sunghak; Shin, Yang Su

    2012-07-01

    In the current study, Fe-based alloys were used for powder injection molding (PIM) parts with various qualities and hardness ranges by varying chemical compositions according to thermodynamically calculated phase diagrams. Their microstructure and hardness values were analyzed and compared with those of the PIM specimens made from conventional Fe-based alloy powders or stainless steel powders. The Cr-to-B ratio ( X Cr/ X B) and the sum of Fe, Cr, and B content ( X Fe+ X Cr+ X B) were varied to design nine Fe-based alloy compositions based on the composition of Armacor "M" alloy powders (Liquidmetal Technologies, Lake Forest, CA). According to the microstructural analysis results of the cast and heat-treated Fe-based alloys, large amounts of (Cr,Fe)2B were formed in the tempered martensite matrix. The volume fraction of (Cr,Fe)2B was varied from 42 pct to 91 pct with alloy compositions, and these results were well matched with the thermodynamically calculated volume fractions of (Cr,Fe)2B. The hardness of the fabricated alloys was varied from 300 VHN to 1600 VHN with alloy compositions, and this value increased linearly with the increasing volume fraction of (Cr,Fe)2B. From the correlation data between the volume fraction of (Cr,Fe)2B and hardness, the high-temperature equilibrium phase diagram, which could be used for the design of Fe-based alloys with various fractions and hardness values of (Cr,Fe)2B, was made.

  8. Magnetic Properties of MnFe2Ga Heusler Alloys

    NASA Astrophysics Data System (ADS)

    Elgendy, Ahmed A.; Salehi-Fashami, Mohammad; Sellmyer, David; Hadjipanayis, George

    2015-03-01

    Recently, MnFe2Ga Heusler alloys have attracted significant attention due to their interesting physical properties such as large magnetic-field-induced strain, giant magnetocaloric effects,large magnetoresistance, and exchange bias behavior. These properties make them promising candidates for various practical applications in the field of smart materials, magnetic refrigeration and spintronics. In this work, we prepared MnFe2Ga alloys by melt-spinning and sputtering and studied the structural and magnetic properties. The melt-spun ribbons were prepared with a wheel speed of 30 m/s. The ribbons were annealed at different temperatures for 1 hour and grinded to make fine powders. The grinded powders were also used to make the target that is used in the cluster gun for the fabrication of MnFe2Ga nanoparticles. The structure of the as made, annealed ribbons, and powders displayed a face-centered-cubic structure. The microstructure of the as-made ribbons showed equiaxed grains with an average size of 3-5 μm while the annealed ribbons showed bigger grains with small particles covering homogeneously their surface. The magnetic properties show an enhancement of magnetization while coercivity remains the same with values M(3T) and HC of 85 emu/g and 150 Oe, respectively Transmission electron microscopy with elemental mapping is currently underway to determine the structure and composition of the surface nanoparticles. The work was supported by DOE-BES-DMSE (Grant No. DE-FG02-04ER4612).

  9. Reduction of Fe(III), Mn(IV), and Toxic Metals at 100°C by Pyrobaculum islandicum

    PubMed Central

    Kashefi, Kazem; Lovley, Derek R.

    2000-01-01

    It has recently been noted that a diversity of hyperthermophilic microorganisms have the ability to reduce Fe(III) with hydrogen as the electron donor, but the reduction of Fe(III) or other metals by these organisms has not been previously examined in detail. When Pyrobaculum islandicum was grown at 100°C in a medium with hydrogen as the electron donor and Fe(III)-citrate as the electron acceptor, the increase in cell numbers of P. islandicum per mole of Fe(III) reduced was found to be ca. 10-fold higher than previously reported. Poorly crystalline Fe(III) oxide could also serve as the electron acceptor for growth on hydrogen. The stoichiometry of hydrogen uptake and Fe(III) oxide reduction was consistent with the oxidation of 1 mol of hydrogen resulting in the reduction of 2 mol of Fe(III). The poorly crystalline Fe(III) oxide was reduced to extracellular magnetite. P. islandicum could not effectively reduce the crystalline Fe(III) oxide minerals goethite and hematite. In addition to using hydrogen as an electron donor for Fe(III) reduction, P. islandicum grew via Fe(III) reduction in media in which peptone and yeast extract served as potential electron donors. The closely related species P. aerophilum grew via Fe(III) reduction in a similar complex medium. Cell suspensions of P. islandicum reduced the following metals with hydrogen as the electron donor: U(VI), Tc(VII), Cr(VI), Co(III), and Mn(IV). The reduction of these metals was dependent upon the presence of cells and hydrogen. The metalloids arsenate and selenate were not reduced. U(VI) was reduced to the insoluble U(IV) mineral uraninite, which was extracellular. Tc(VII) was reduced to insoluble Tc(IV) or Tc(V). Cr(VI) was reduced to the less toxic, less soluble Cr(III). Co(III) was reduced to Co(II). Mn(IV) was reduced to Mn(II) with the formation of manganese carbonate. These results demonstrate that biological reduction may contribute to the speciation of metals in hydrothermal environments and could

  10. Atomistic investigation of Cr influence on primary radiation damage in Fe-12 at.% Cr grain boundaries

    NASA Astrophysics Data System (ADS)

    Esfandiarpour, A.; Feghhi, S. A. H.; Arjhangmehr, A.

    2016-08-01

    In this paper, we investigate the influence of Cr on the primary radiation damage in Fe-12 at.% Cr with different atomic grain boundaries (GBs). Four different GB structures, two twists and two symmetric tilt boundaries are selected as the model structures. The primary radiation damage near each GB in α-Fe and Fe-12 at.% Cr is simulated using Molecular Dynamics for 9 keV primary knock-on atoms with velocity vectors perpendicular to the GB plane. In agreement with previous works, the results indicate that the atomic GBs are biased toward interstitials and due to the reduction of ‘in-cascade’ interstitial-vacancy annihilation rates, vacancies accumulate in the bulk grains. The minimum defect production occurs when the overlap between cascade center and GB plane is maximum; in contrast, the number of residual defects in the bulk (vacancies and interstitials) increases when the overlap decreases. Moreover, we find that the presence of Cr hardly affects the number of residual defects in the grain interiors, and causes a Cr-enrichment in the surviving self-interstitial atoms in bulk during relaxation of the primary cascades—also in agreement with previous studies. Further, in order to study the effect of 12 at.% Cr on the energetic and kinetic properties of vacancies near the atomic GBs, we calculate formation energies and diffusion barriers of defects using Molecular Static and climbing-Nudged Elastic Band methods. The results reveal that the vacancies energetically and kinetically tend to form and cluster around the GB plane due to the substantial reduction of their formation energies and migration barriers in layers close to the GB center and are immobile on the simulated time frame (~ps).

  11. Effective adsorption of Cr(VI) on mesoporous Fe-functionalized Akadama clay: Optimization, selectivity, and mechanism

    NASA Astrophysics Data System (ADS)

    Ji, Min; Su, Xiao; Zhao, Yingxin; Qi, Wenfang; Wang, Yue; Chen, Guanyi; Zhang, Zhenya

    2015-07-01

    A Japanese volcanic soil, Akadama clay, was functionalized with metal salts (FeCl3, AlCl3, CaCl2, MgCl2, MnCl2) and tested for Cr(VI) removal from aqueous solution. FeCl3 was selected as the most efficient activation agent. To quantitatively investigate the independent or interactive contribution of influencing factors (solution pH, contact time, adsorbent dose, and initial concentration) to Cr(VI) adsorption onto Fe-functionalized AC (FFAC), factorial experimental design was applied. Results showed initial concentration contributed most to adsorption capacity of Cr(VI) (53.17%), followed by adsorbent dosage (45.15%), contact time (1.12%) and the interaction between adsorbent dosage and contact time (0.37%). The adsorption showed little dependence on solution pH from 2 to 8. Adsorption selectivity of Cr(VI) was evaluated through analyzing distribution coefficient, electrical double layer theory, as well as the valence and Pauling's ionic radii of co-existing anions (Cl-, SO42-, and PO43-). EDX and XPS analyses demonstrated the adsorption mechanism of Cr(VI) onto FFAC included electrostatic attraction, ligant exchange, and redox reaction. Improved treatment for tannery wastewater shows a potential application of FFAC as a cost-effective adsorbent for Cr(VI) removal.

  12. Fe-species-loaded mesoporous MnO2 superstructural requirements for enhanced catalysis.

    PubMed

    Huang, Ruting; Liu, Yanyu; Chen, Zhiwen; Pan, Dengyu; Li, Zhen; Wu, Minghong; Shek, Chan-Hung; Wu, C M Lawrence; Lai, Joseph K L

    2015-02-25

    In this work, a novel catalyst, Fe-species-loaded mesoporous manganese dioxide (Fe/M-MnO2) urchinlike superstructures, has been fabricated successfully in a two-step technique. First, mesoporous manganese dioxide (M-MnO2) urchinlike superstructures have been synthesized by a facile method on a soft interface between CH2Cl2 and H2O without templates. Then the M-MnO2-immobilized iron oxide catalyst was obtained through wetness impregnation and calcination. Microstructural analysis indicated that the M-MnO2 was composed of urchinlike hollow submicrospheres assembled by nanorod building blocks with rich mesoporosity. The Fe/M-MnO2 retained the hollow submicrospheres, which were covered by hybridized composites with broken and shortened MnO2 nanorods. Energy-dispersive X-ray microanalysis was used to determine the availability of Fe loading processes and the homogeneity of Fe in Fe/M-MnO2. Catalytic performances of the M-MnO2 and Fe/M-MnO2 were evaluated in catalytic wet hydrogen peroxide oxidation of methylene blue (MB), a typical organic pollutant in dyeing wastewater. The catalytic degradation displayed highly efficient discoloration of MB when using the Fe/M-MnO2 catalyst, e.g., ca. 94.8% of MB was decomposed when the reaction was conducted for 120 min. The remarkable stability of this Fe/M-MnO2 catalyst in the reaction medium was confirmed by an iron leaching test and reuse experiments. Mechanism analysis revealed that the hydroxyl free radical was responsible for the removal of MB and catalyzed by M-MnO2 and Fe/M-MnO2. MB was transformed into small organic compounds and then further degraded into CO2 and H2O. The new insights obtained in this study will be beneficial for the practical applications of heterogeneous catalysts in wastewater treatments. PMID:25626157

  13. Core Formation in the Earth and Moon: New Constraints From V, Cr, and Mn Partitioning Experiments

    NASA Astrophysics Data System (ADS)

    Chabot, N. L.; Agee, C. B.

    2002-05-01

    The mantles of the Earth and Moon are similarly depleted in V, Cr, and Mn relative to the concentrations of these elements in chondritic meteorites [1,2]. The similar depletions have been suggested to be due to a common genesis of the Earth and Moon, with the Moon inheriting its mantle, complete with V, Cr, and Mn depletions, from the Earth during the impact-induced formation of the Moon. We have conducted multi-anvil experiments that systematically examined the effects of pressure, temperature, and silicate and metallic compositions on liquid metal-liquid silicate partitioning of V, Cr, and Mn. Increasing temperature is found to significantly increase the metal-silicate partition coefficients for all three elements. Increasing the S or C content of the metallic liquid also causes the partition coefficients to increase. Silicate composition has an effect consistent with Cr and Mn being divalent and V being trivalent. Over our experimental range of 3-14 GPa, the partitioning behavior of V, Cr, and Mn did not vary with pressure. With the effects of oxygen fugacity, metallic and silicate compositions, temperature and pressure understood, the partition coefficient for each element was expressed as a function of these thermodynamic variables and applied to different core formation scenarios. Our new metal-silicate experimental partitioning data can explain the mantle depletions of V, Cr, and Mn by core formation in a high temperature magma ocean under oxygen fugacity conditions two log units below the iron-wuestite buffer, conditions similar to those proposed by [3] from their metal-magnesiowuestite study. In contrast, more oxidizing conditions proposed in recent core formation models [4] cannot account for the V, Cr, and Mn depletions. Additionally, because we observe little or no pressure effect on V, Cr, and Mn partitioning in our experiments, we conclude that the mantle depletions of these elements during core formation are not dependent on planet size. Accordingly

  14. Constraining the Material that Formed the Moon: The Origin of Lunar V, CR, and MN Depletions

    NASA Technical Reports Server (NTRS)

    Chabot, N. L.; Agee, C. B.

    2002-01-01

    The mantles of the Earth and Moon are similarly depleted in V, Cr, and Mn relative to chondritic values. Core formation deep within the Earth was suggested by as the origin of the depletions. Following Earth's core formation, the Moon was proposed to have inherited its mantle from the depleted mantle of the Earth by a giant impact event. This theory implied the Moon was primarily composed of material from the Earth's mantle. Recent systematic metal-silicate experiments of V, Cr, and Mn evaluated the behavior of these elements during different core formation scenarios. The study found that the V, Cr, and Mn depletions in the Earth could indeed be explained by core formation. The conditions of core formation necessary to deplete V, Cr, and Mn in the Earth's mantle were consistent with the deep magma ocean proposed to account for the Earth's mantle abundances of Ni and Co. Using the parameterizations of for the metal-silicate partition coefficients (D) of V, Cr, and Mn, we investigate here the conditions needed to match the depletions in the silicate Moon and determine if such conditions could have been present on the giant impactor.

  15. Effect of Carbide Ceramic Zone on Wear Resistance of the (Fe,Cr)7C3/Fe Surface Gradient Composite

    NASA Astrophysics Data System (ADS)

    Ye, Fangxia; Xu, Yunhua; Hojamberdiev, Mirabbos; Lai, Yujun; Wang, Chong; Wang, Xin

    2015-08-01

    In this work, we report on the influence of microstructure and mechanical properties of the (Fe,Cr)7C3 ceramic zone on wear resistance of the (Fe,Cr)7C3/Fe surface gradient composite fabricated by in situ synthesis method followed by a post-heat treatment at 1100 °C for 20 h in argon atmosphere. The phase composition, microstructure, nanoindentation hardness, elastic modulus, fracture toughness, and relative wear resistance of the (Fe,Cr)7C3/Fe surface gradient composite were investigated by means of x-ray diffraction, scanning electron microscopy, nanoindentation tester, and wear resistance testing instrument, respectively. The XRD results showed that (Fe,Cr)7C3 is the predominant crystalline phases in the fabricated composite. The volume fraction of the (Fe,Cr)7C3 particulates formed has a gradient distribution from the surface to the iron matrix, and the microstructure also changes significantly. The (Fe,Cr)7C3 bulk ceramic zone with the volume fraction of about 100% and the (Fe,Cr)7C3 dense ceramic zone with the volume fraction of about 90% were synthesized on the upper surface of the (Fe,Cr)7C3/Fe surface gradient composite, respectively. The average nanoindentation hardness and elastic modulus of the (Fe,Cr)7C3 bulk ceramic zone of the composite were determined to be 12.711 and 256.054 GPa, respectively. The fracture toughness of the (Fe,Cr)7C3 bulk ceramic zone is in the range of 2.06-4.19 MPa m1/2, and its relative wear resistance is about 56 times higher than that of the iron matrix. The (Fe,Cr)7C3 dense ceramic zone with rod-like, secondary (Fe,Cr)7C3 particulates was formed at the bottom of the (Fe,Cr)7C3 bulk ceramic zone. Rod-like, secondary (Fe,Cr)7C3 particulates are dense and grew in the direction of the iron substrate, providing higher wear resistance to the composite. The wear mechanisms of the (Fe,Cr)7C3 bulk and dense ceramic zones are considered to be microcutting, microcracking, and spalling pit.

  16. The Corrosion Resistance of Fe-Based Amorphous Metals: Fe49.7Cr17.7Mn1.9Mo7.4W1.6B15.2C3.8Si2.4 and Other Compositions

    SciTech Connect

    Farmer, J; Haslam, J; Day, S; Lian, T; Saw, C; Hailey, P; Choi, J; Rebak, R; Payer, J; Blue, C; Peters, W; Branagan, D

    2007-07-09

    Several Fe-based amorphous metals were developed with good corrosion resistance. These materials have been produced as melt-spun ribbons, ingots, and thermal-spray coatings. Cyclic polarization has been conducted in several aggressive environments, at ambient temperature, as well as temperatures approaching the boiling points of the test solutions. The hypothesis that the corrosion resistance of iron-based amorphous metals can be enhanced through application of heuristic principles related to the additions of chromium, molybdenum, tungsten has been tested and found to have merit. Chromium (Cr), molybdenum (Mo) and tungsten (W) provide corrosion resistance; boron (B) enables glass formation; and rare earths such as yttrium (Y) lower critical cooling rate (CCR). The high boron content of this particular amorphous metal makes this amorphous alloy an effective neutron absorber, and suitable for criticality control applications. In general, the corrosion resistance of such iron-based amorphous metals is maintained at operating temperatures up to the glass transition temperature.

  17. Cu-Mn-Fe alloys and Mn-rich amphiboles in ancient copper slags from the Jabal Samran area, Saudi Arabia: With synopsis on chemistry of Fe-Mn(III) oxyhydroxides in alteration zones

    NASA Astrophysics Data System (ADS)

    Surour, Adel A.

    2015-01-01

    In the Jabal Samran area (western Saudi Arabia), secondary copper mineralization in a NE-trending shear zone in which the arc metavolcanic host rocks (dacite-rhyodacite) show conjugate fractures and extensive hydrothermal alteration and bleaching. The zones contain frequent Fe-Mn(III) oxyhydroxides (FeOH-MnOH) that resulted from oxidation of pyrite and Mn-bearing silicates. In the bleached part, the groundmass is represented by Fe-bearing interstratified illite-smectite with up to 4.02 wt% FeOt. FeOH-MnOH are pre-weathering phases formed by hydrothermal alteration in a submarine environment prior to uplifting. Five varieties of FeOH are distinguished, four of them are exclusively hydrothermal with ∼20 wt% H2O whereas the fifth contains ∼31-33 wt% H2O and might represent reworking of earlier hydrothermal FeOH phases by weathering. FeOH fills thin fractures in the form of veinlets and crenulated laminae or as a pseudomorph for pyrite, goethite and finally ferrihydrite, and this oxyhydroxide is characterized by positive correlation of Fe2O3 with SiO2 and Al2O3. On the other hand, MOH shows positive correlation between MnO2 and Al2O3 whereas it is negative between Fe2O3 and SiO2. Paratacamite is the most common secondary copper mineral that fills fractures and post-dates FeOH and MnOH. It is believed that Cl- in the structure of paratacamite represents inherited marine storage rather than from surfacial evaporates or meteoric water. The mineralogy of slags suggests a complicated mineral assemblage that includes native Cu prills, synthetic spinifixed Mn-rich amphiboles with 16.73 wt% MnO, brown glass and Ca-Mn-Fe phase close to the olivine structure. EMPA indicate that the some Cu prills have either grey discontinuous boarder zone of S-rich Mn-Cu alloy (with up to 21.95 wt% S and 19.45 wt% Mn) or grey Cu-Mn-Fe alloy (with up to 15.9 wt% Cu, 39. 12 wt% Mn and 61.64 wt% Fe). Mn in the Cu prills is expelled inward as Cu-Mn-Fe alloy inclusions whereas S is expelled

  18. Fe-Mg-Mn relations of ureilite olivines and pyroxenes and the genesis of ureilites

    NASA Technical Reports Server (NTRS)

    Mittlefehldt, D. W.

    1986-01-01

    Microprobe analyses of ureilite and pigeonite cores are studied. The Fe/Mn-Fe/Mg relationship in the olivine core is examined. It is observed that magnetic processs such as fractional crystallization and partial melting, and FeO reduction contribute to the olivine core composition. The study of the Mg/Mn and Fe/Mn distributions reveals that these two distributions are not in equilibrium in the olivine and pigeonite cores. The effect of a reducing agent, carbon, on the ureilite genesis is investigated. It is concluded that fractional crystallization and FeO reduction are the major processes of ureilite genesis.

  19. Decay properties of 68,69,70Mn: Probing collectivity up to N = 44 in Fe isotopic chain

    NASA Astrophysics Data System (ADS)

    Benzoni, G.; Morales, A. I.; Watanabe, H.; Nishimura, S.; Coraggio, L.; Itaco, N.; Gargano, A.; Browne, F.; Daido, R.; Doornenbal, P.; Fang, Y.; Lorusso, G.; Patel, Z.; Rice, S.; Sinclair, L.; Söderström, P.-A.; Sumikama, T.; Wu, J.; Xu, Z. Y.; Yokoyama, R.; Baba, H.; Avigo, R.; Bello Garrote, F. L.; Blasi, N.; Bracco, A.; Camera, F.; Ceruti, S.; Crespi, F. C. L.; de Angelis, G.; Delattre, M.-C.; Dombradi, Zs.; Gottardo, A.; Isobe, T.; Kuti, I.; Matsui, K.; Melon, B.; Mengoni, D.; Miyazaki, T.; Modamio-Hoybjor, V.; Momiyama, S.; Napoli, D. R.; Niikura, M.; Orlandi, R.; Sakurai, H.; Sahin, E.; Sohler, D.; Taniuchi, R.; Taprogge, J.; Vajta, Zs.; Valiente-Dobón, J. J.; Wieland, O.; Yalcinkaya, M.

    2015-12-01

    The β decays 68Mn →68Fe, 69Mn →69Fe and 70Mn →70Fe have been measured at the RIBF facility at RIKEN using the EURICA γ spectrometer combined with an active stopper consisting of a stack of Si detectors. The nuclei were produced as fission fragments from a beam of 238U at a bombarding energy of 345 MeV/nucleon impinging on a Be target and selected using the BigRIPS separator. Half-lives and β-delayed neutron emission probabilities have been extracted for these decays, together with first experimental information on excited states populated in 69,70Fe. The data indicate a continuously increasing deformation for Fe isotopes up to A = 70. This is interpreted, as for Cr isotopes, in terms of the interplay between the quadrupole correlations of the ν 1d5/2 and ν 0g9/2 orbitals and the monopole component of the π 0f7/2- ν 0f5/2 interaction.

  20. Experimental Study on Dynamic Mechanical Properties of 30CrMnSiNi2A Steel.

    NASA Astrophysics Data System (ADS)

    Huang, Fenglei; Yao, Wei; Wu, Haijun; Zhang, Liansheng

    2009-06-01

    Under dynamic conditions, the strain-rate dependence of material response and high levels of hydrostatic pressure cause the material behavior to be significantly different from what is observed under quasi-static condition. The curves of stress and strain of 30CrMnSiNi2A steel in different strain rates are obtained with SHPB experiments. Metallographic analyses show that 30CrMnSiNi2A steel is sensitive to strain rate, and dynamic compression leads to shear failure with the angle 45^o as the small carbide which precipitates around grain boundary changes the properties of 30CrMnSiNi2A steel. From the SHPB experiments and quasi-static results, the incomplete Johnson-Cook model has been obtained: σ=[1587+382.5(ɛ^p)^0.245][1+0.017ɛ^*], which can offer parameters for theory application and numerical simulation.

  1. Ligational behaviour of lomefloxacin drug towards Cr(III), Mn(II), Fe(III), Co(II), Ni(II), Cu(II), Zn(II), Th(IV) and UO(2)(VI) ions: synthesis, structural characterization and biological activity studies.

    PubMed

    Abd el-Halim, Hanan F; Mohamed, Gehad G; el-Dessouky, Maher M I; Mahmoud, Walaa H

    2011-11-01

    Nine new mononuclear Cr(III), Mn(II), Fe(III), Co(II), Ni(II), Cu(II), Zn(II), Th(IV) and UO(2)(VI) complexes of lomefloxacin drug were synthesized. The structures of these complexes were elucidated by elemental analyses, IR, XRD, UV-vis, (1)H NMR as well as conductivity and magnetic susceptibility measurements and thermal analyses. The dissociation constants of lomefloxacin and stability constants of its binary complexes have been determined spectrophotometrically in aqueous solution at 25±1°C and at 0.1 M KNO(3) ionic strength. The discussion of the outcome data of the prepared complexes indicate that the lomefloxacin ligand behaves as a neutral bidentate ligand through OO coordination sites and coordinated to the metal ions via the carbonyl oxygen and protonated carboxylic oxygen with 1:1 (metal:ligand) stoichiometry for all complexes. The molar conductance measurements proved that the complexes are electrolytes. The powder XRD study reflects the crystalline nature for the investigated ligand and its complexes except Mn(II), Zn(II) and UO(2)(II). The geometrical structures of these complexes are found to be octahedral. The thermal behaviour of these chelates is studied where the hydrated complexes lose water molecules of hydration in the first steps followed by decomposition of the anions, coordinated water and ligand molecules in the subsequent steps. The activation thermodynamic parameters are calculated using Coats-Redfern and Horowitz-Metzger methods. A comparative study of the inhibition zones of the ligand and its metal complexes indicates that metal complexes exhibit higher antibacterial effect against one or more bacterial species than the free LFX ligand. The antifungal and anticancer activities were also tested. The antifungal effect of almost metal complexes is higher than the free ligand. LFX, [Co(LFX)(H(2)O)(4)]·Cl(2) and [Zn(LFX)(H(2)O)(4)]·Cl(2) were found to be very active with IC50 values 14, 11.2 and 43.1, respectively. While, other

  2. Magnetic and structural properties of ferromagnetic Fe5PB2 and Fe5SiB2 and effects of Co and Mn substitutions

    SciTech Connect

    McGuire, Michael A.; Parker, David S.

    2015-10-22

    Crystallographic and magnetic properties of Fe5PB2, Fe4CoPB2, Fe4MnPB2, Fe5SiB2, Fe4CoSiB2, and Fe4MnSiB2 are reported. All adopt the tetragonal Cr5B3 structure-type and are ferromagnetic at room temperature with easy axis of magnetization along the c-axis. The spin reorientation in Fe5SiB2 is observed as an anomaly in the magnetization near 170 K, and is suppressed by substitution of Co or Mn for Fe. The silicides are found to generally have larger magnetic moments than the phosphides, but the data suggests smaller magnetic anisotropy in the silicides. Cobalt substitution reduces the Curie temperatures by more than 100 K and ordered magnetic moments by 16-20%, while manganese substitution has a much smaller effect. This suggests Mn moments align ferromagnetically with the Fe and that Co does not have an ordered moment in these structures. Anisotropic thermal expansion is observed in Fe5PB2 and Fe5SiB2, with negative thermal expansion seen along the c-axis of Fe5SiB2. First principles calculations of the magnetic properties of Fe5SiB2 and Fe4MnSiB2 are reported. The results, including the magnetic moment and anisotropy, and are in good agreement with experiment.

  3. Magnetic and structural properties of ferromagnetic Fe{sub 5}PB{sub 2} and Fe{sub 5}SiB{sub 2} and effects of Co and Mn substitutions

    SciTech Connect

    McGuire, Michael A. Parker, David S.

    2015-10-28

    Crystallographic and magnetic properties of Fe{sub 5}PB{sub 2}, Fe{sub 4}CoPB{sub 2}, Fe{sub 4}MnPB{sub 2}, Fe{sub 5}SiB{sub 2}, Fe{sub 4}CoSiB{sub 2}, and Fe{sub 4}MnSiB{sub 2} are reported. All adopt the tetragonal Cr{sub 5}B{sub 3} structure-type and are ferromagnetic at room temperature with easy axis of magnetization along the c-axis. The spin reorientation in Fe{sub 5}SiB{sub 2} is observed as an anomaly in the magnetization near 170 K and is suppressed by substitution of Co or Mn for Fe. The silicides are found to generally have larger magnetic moments than the phosphides, but the data suggest smaller magnetic anisotropy in the silicides. Cobalt substitution reduces the Curie temperatures by more than 100 K and ordered magnetic moments by 16%–20%, while manganese substitution has a much smaller effect. This suggests Mn moments align ferromagnetically with the Fe and that Co does not have an ordered moment in these structures. Anisotropic thermal expansion is observed in Fe{sub 5}PB{sub 2} and Fe{sub 5}SiB{sub 2}, with negative thermal expansion seen along the c-axis of Fe{sub 5}SiB{sub 2}. First principles calculations of the magnetic properties of Fe{sub 5}SiB{sub 2} and Fe{sub 4}MnSiB{sub 2} are reported. The results, including the magnetic moment and anisotropy, are in good agreement with experiment.

  4. Influence of FeCrAl Content on Microstructure and Bonding Strength of Plasma-Sprayed FeCrAl/Al2O3 Coatings

    NASA Astrophysics Data System (ADS)

    Zhou, Liang; Luo, Fa; Zhou, Wancheng; Zhu, Dongmei

    2016-02-01

    Low-power plasma-sprayed FeCrAl/Al2O3 composite coatings with 1.5 mm thickness have been fabricated for radar absorption applications. The effects of FeCrAl content on the coating properties were studied. The FeCrAl presents in the form of a few thin lamellae and numerous particles, demonstrating relatively even distribution in all the coatings. Results show that the micro-hardness and porosity decrease with the increase in FeCrAl content. With FeCrAl content increasing from 28 to 47 wt.%, the bonding strength of the coatings with 1.5 mm thickness increases from 10.5 to 27 MPa, and the failure modes are composed of cohesive and adhesive failure, which are ascribed to the coating microstructure and the residual stress, respectively.

  5. Oxidation behavior of Fe-20Cr steels alloyed with titanium at 1073 K

    NASA Astrophysics Data System (ADS)

    Setiawan, Asep Ridwan; Artono, Tri Juni

    2016-02-01

    In this work, the oxidation behavior of Fe-20 wt%Cr steels alloyed with different titanium contents: 0, 0.5, and 1 wt% are studied as a function of time in air atmosphere. The samples were isothermally oxidized at 1073 K for 86.4, 172.8, and 345.6 ks in a muffle furnace. The mass of specimen were recorded before and after oxidation. After the oxidation, phases in the oxide were identified by X-ray diffraction (XRD). Optical microscopy observation on the chromium base alloys show that the microstructure consist only ferritic phases. The addition of titanium in the Fe-20Cr alloys does not alter the microstructure significantly. The oxidation behavior of Fe-20Cr, Fe-20Cr-0.5Ti and Fe-20Cr-1Ti were followed the classical parabolic relationship with time. XRD analysis indicated that the oxide scales developed on the Fe-20Cr alloys surface during oxidation tests consisted mainly of Cr2O3. On the other hand, the oxide scales developed on the surface of Fe-20Cr-0.5Ti and Fe-20Cr-1Ti alloys comprised of Cr2O3 and TiO2 oxide. The formation of TiO2 oxide in the Ti-containing alloys consequently increases the mass gain of the alloys during oxidation compared to that of Fe-20Cr alloys.

  6. A dedicated AMS setup for 53Mn/60Fe at the Cologne FN tandem accelerator

    NASA Astrophysics Data System (ADS)

    Schiffer, M.; Dewald, A.; Feuerstein, C.; Altenkirch, R.; Stolz, A.; Heinze, S.

    2015-10-01

    Following demands for AMS measurements of medium mass isotopes, especially for 53Mn and 60Fe, we started to build a dedicated AMS setup at the Cologne FN tandem accelerator. This accelerator with a maximum terminal voltage of 10 MV can be reliably operated at a terminal voltage of 9.5 MV which corresponds to energies of 93-102 MeV for 60Fe or 53Mn beams using the 9+ or 10+ charge state. These charge states can be obtained by foil stripping with efficiencies of 30% and 20%, respectively. Energies around 100 MeV are sufficient to effectively suppress the stable isobars 60Ni and 53Cr by (dE/dx) techniques using combinations of energy degrader foils and dispersive elements like electrostatic analyzers and time of flight (TOF) systems as well as (dE/dx)E ion detectors. In this contribution we report on the actual status of the AMS setup and discuss details and expected features.

  7. The improvement of cryogenic mechanical properties of Fe-12 Mn and Fe-8 Mn alloy steels through thermal/mechanical treatments

    NASA Technical Reports Server (NTRS)

    Hwang, S. K.; Morris, J. W., Jr.

    1979-01-01

    An investigation has been made to improve the low temperature mechanical properties of Fe-8Mn and Fe-12Mn-0.2 Ti alloy steels. A reversion annealing heat treatment in the two-phase (alpha + gamma) region following cold working has been identified as an effective treatment. In an Fe-12Mn-0.2Ti alloy a promising combination of low temperature (-196 C) fracture toughness and yield strength was obtained by this method. The improvement of properties was attributed to the refinement of grain size and to the introduction of a uniform distribution of retained austenite (gamma). It was also shown that an Fe-8Mn steel could be grain-refined by a purely thermal treatment because of its dislocated alpha-prime martensitic structure and absence of epsilon martensite. As a result, a significant reduction of ductile to brittle transition temperature was obtained.

  8. Oxidation behavior of cubic phases formed by alloying Al3Ti with Cr and Mn

    NASA Technical Reports Server (NTRS)

    Parfitt, L. J.; Nic, J. P.; Mikkola, D. E.; Smialek, J. L.

    1991-01-01

    Gravimetric, SEM, and XRD data are presented which document the significant improvement obtainable in the oxidation resistance of Al3Ti-containing alloys through additions of Cr. The L1(2) Al(67)Cr(8)Ti25 alloy exhibited excellent cyclic oxidation resistance at 1473 K, with the primary oxide formed being the ideally protective alpha-Al2O3. The Al(67)Mn(8)Ti(25) alloy also tested for comparison exhibited poor cyclic oxidation resistance, with substantial occurrence of TiO2 in the protective scales. Catastrophic oxidation was also encountered in the quaternary alloy Al(67)Mn(8)Ti(22)V(3).

  9. Removal of Cr(VI) from Cr-contaminated groundwater through electrochemical addition of Fe(II).

    PubMed

    Mukhopadhyay, Biswajit; Sundquist, Jon; Schmitz, Rodney J

    2007-01-01

    The conventional chemical reduction-precipitation technique in the removal of Cr(VI) from contaminated groundwater involves a two-step process whereby Cr(VI) is first reduced to Cr(III) at an acidic pH by a reducing agent and in a subsequent step, Cr(III) is precipitated as insoluble hydroxide at an alkaline pH. In a variation of this method, Fe(II) is added electrochemically to the Cr(VI) containing water. From a pure iron electrode, Fe(2+) ions are released into the solution and bring forth the reduction of Cr(VI). At the cathode, H(2)O is reduced whereby the OH(-) ions entering the solution keep the pH of the solution in the alkaline range. This latter fact greatly facilitates simultaneous reduction of Cr(VI) to Cr(III) and co-precipitation of hydroxides of trivalent Cr and Fe. On the basis of a set of experimental data, it is shown that this process is both thermodynamically and kinetically efficient, meaning, with the electrochemical method, rapid and nearly complete removal of Cr(VI) from a groundwater source with both high and low levels of Cr-contamination can be achieved. These factors make the electrochemical process superior to the conventional chemical process in remediation of Cr-contaminated groundwater.

  10. New type of Schottky diode-based Cu-Al-Mn-Cr shape memory material films

    NASA Astrophysics Data System (ADS)

    Aksu Canbay, C.; Dere, A.; Mensah-Darkwa, Kwadwo; Al-Ghamdi, Ahmed; Karagoz Genç, Z.; Gupta, R. K.; Yakuphanoglu, F.

    2016-07-01

    Cr-doped CuAlMn shape memory alloys were produced by arc melting method. The effects of Cr content on microstructure and transformation parameters of were investigated. The alloys were characterized by X-ray analysis, optical microscope observations and differential scanning calorimetry measurements. The grain size of the alloys was decreased by the addition of Cr into CuAlMn alloy system. The martensite transformation temperature was shifted both the lower temperature and higher temperature with the addition of chromium. This change was explained on the basis of the change in the thermodynamics such as enthalpy, entropy and activation energy values. The obtained results indicate that the phase transformation temperatures of the CuAlMn alloy system can be controlled by addition of Cr. We fabricated a Schottky barrier diode and observed that ideality factor and barrier height increase with increasing temperature. The diodes exhibited a thermal sensor behavior. This indicates that Schottky diode-based Cu-Al-Mn-Cr shape memory material films can be used as a sensor in high-temperature measurement applications.

  11. Mn-53-Cr-53 Systematics of R-Chondrite NWA 753

    NASA Technical Reports Server (NTRS)

    Jogo, K.; Shih, C-Y.; Reese, Y. D.; Nyquist, L. E.

    2006-01-01

    Chondrules and chondrites are interpreted as objects formed in the early solar system, and it is important to study them in order to elucidate its evolution. Here, we report the study of the Mn-Cr systematics of the R-Chondrite NWA753 and compare the results to other chondrite data. The goal was to determine Cr isotopic and age variations among chondrite groups with different O-isotope signatures. The Mn-53-Cr-53 method as applied to individual chondrules [1] or bulk chondrites [2] is based on the assumption that 53Mn was initially homogeneously distributed in that portion the solar nebula where the chondrules and/or chondrites formed. However, different groups of chondrites formed from regions of different O-isotope compositions. So, different types of chondrites also may have had different initial Mn-53 abundances and/or Cr isotopic compositions. Thus, it is important to determine the Cr isotopic systematics among chondrites from various chondrite groups. We are studying CO-chondrite ALH83108 and Tagish Lake in addition to R-Chondrite NWA753. These meteorites have very distinct O-isotope compositions (Figure 1).

  12. Dielectric function of the ferromagnetic semiconductor CdMnCrTe studied by using spectroscopic ellipsometry

    NASA Astrophysics Data System (ADS)

    Hwang, Younghun; Um, Youngho

    2014-11-01

    We describe the pseudo-dielectric function of Cd1- x- y Mn x Cr y Te ferromagnetic semiconductor alloys by using spectroscopic ellipsometry in the 1.0 ~ 6.0 eV spectral range at room temperature. The ellipsometry data include structures that can be attributed to the effects of Cr concentration on the E 0, E 1, E 1 + Δ1, and E 2 critical points. Critical-point (CP) parameters were obtained by fitting standard critical point (SCP) model line shapes to the numerically-calculated second- energy derivatives of ɛ( ω) = ɛ 1( ω) + iɛ 2( ω). The E 0, E 1, E 1 + Δ1, and E 2 energies decreased with Cr content y; this phenomenon is related to the hybridization of the valence and the conduction bands in CdTe with the 3 d states of Mn and Cr.

  13. Phase Separation kinetics in an Fe-Cr-Al alloy

    SciTech Connect

    Capdevila, C.; Miller, Michael K; Chao, J.

    2012-01-01

    The {alpha}-{alpha}{prime} phase separation kinetics in a commercial Fe-20 wt.% Cr-6 wt.% Al oxide dispersion-strengthened PM 2000{trademark} steel have been characterized with the complementary techniques atom probe tomography and thermoelectric power measurements during isothermal aging at 673, 708, and 748 K for times up to 3600 h. A progressive decrease in the Al content of the Cr-rich {alpha}{prime} phase was observed at 708 and 748 K with increasing time, but no partitioning was observed at 673 K. The variation in the volume fraction of the {alpha}{prime} phase well inside the coarsening regime, along with the Avrami exponent 1.2 and activation energy 264 kJ mol{sup -1}, obtained after fitting the experimental results to an Austin-Rickett type equation, indicates that phase separation in PM 2000{trademark} is a transient coarsening process with overlapping nucleation, growth, and coarsening stages.

  14. Spin-driven ordering of Cr in the equiatomic high entropy alloy NiFeCrCo

    SciTech Connect

    Niu, C.; Zaddach, A. J.; Oni, A. A.; Sang, X.; LeBeau, J. M.; Koch, C. C.; Irving, D. L.; Hurt, J. W.

    2015-04-20

    Spin-driven ordering of Cr in an equiatomic fcc NiFeCrCo high entropy alloy (HEA) was predicted by first-principles calculations. Ordering of Cr is driven by the reduction in energy realized by surrounding anti-ferromagnetic Cr with ferromagnetic Ni, Fe, and Co in an alloyed L1{sub 2} structure. The fully Cr-ordered alloyed L1{sub 2} phase was predicted to have a magnetic moment that is 36% of that for the magnetically frustrated random solid solution. Three samples were synthesized by milling or casting/annealing. The cast/annealed sample was found to have a low temperature magnetic moment that is 44% of the moment in the milled sample, which is consistent with theoretical predictions for ordering. Scanning transmission electron microscopy measurements were performed and the presence of ordered nano-domains in cast/annealed samples throughout the equiatomic NiFeCrCo HEA was identified.

  15. Effects of Cr and Ni on Interdiffusion and Reaction between U and Fe-Cr-Ni Alloys

    SciTech Connect

    K. Huang; Y. Park; L. Zhou; K.R. Coffey; Y.H. Sohn; B.H. Sencer; J. R. Kennedy

    2014-08-01

    Metallic U-alloy fuel cladded in steel has been examined for high temperature fast reactor technology wherein the fuel cladding chemical interaction is a challenge that requires a fundamental and quantitative understanding. In order to study the fundamental diffusional interactions between U with Fe and the alloying effect of Cr and Ni, solid-to-solid diffusion couples were assembled between pure U and Fe, Fe–15 wt.%Cr or Fe–15 wt.%Cr–15 wt.%Ni alloy, and annealed at high temperature ranging from 580 to 700 °C. The microstructures and concentration profiles that developed from the diffusion anneal were examined by scanning electron microscopy, and X-ray energy dispersive spectroscopy (XEDS), respectively. Thick U6Fe and thin UFe2 phases were observed to develop with solubilities: up to 2.5 at.% Ni in U6(Fe,Ni), up to 20 at.%Cr in U(Fe, Cr)2, and up to 7 at.%Cr and 14 at.% Ni in U(Fe, Cr, Ni)2. The interdiffusion and reactions in the U vs. Fe and U vs. Fe–Cr–Ni exhibited a similar temperature dependence, while the U vs. Fe–Cr diffusion couples, without the presence of Ni, yielded greater activation energy for the growth of intermetallic phases – lower growth rate at lower temperature but higher growth rate at higher temperature.

  16. Cr segregation at the FeCr surface and the origin of corrosion resistance in ferritic steels

    SciTech Connect

    De Caro, M S; Morse, B; Egiebor, N; Farmer, J; Caro, A

    2008-11-22

    Structural materials in Gen-IV nuclear reactors will face severe conditions of high operating temperatures, high neutron flux exposure, and corrosive environment. Radiation effects and corrosion and chemical compatibility issues are factors that will limit the materials lifetime. Low-chromium (9-12 Cr wt.%) ferritic martensitic (F/M) steels are being considered as possible candidates because they offer good swelling resistance and good mechanical properties under extreme conditions of radiation dose and irradiation temperature. The surface chemistry of FeCr alloys, responsible for the corrosion properties, is complex. It exists today a controversy between equilibrium thermodynamic calculations, which suggest Cr depletion at the surface driven by the higher surface energy of Cr, and experimental data which suggest the oxidation process occurs in two stages, first forming a Fe-rich oxide, followed by a duplex oxide layer, and ending with a Cr-rich oxide. Moreover, it has been shown experimentally that corrosion resistance of F/M steels depends significantly on Cr content, increasing with increasing Cr content and with a threshold around 10% Cr, below which, the alloy behaves as pure Fe. In an attempt to rationalize these two contradicting observations and to understand the physical mechanism behind corrosion resistance in these materials we perform atomistic simulations using our FeCr empirical potential and analyze Cr equilibrium distributions at different compositions and temperatures in single and polycrystalline samples. We analyze the controversy in terms of thermodynamic and kinetic considerations.

  17. Oxidation sulfidation resistance of Fe-Cr-Ni alloys

    DOEpatents

    Natesan, Ken; Baxter, David J.

    1984-01-01

    High temperature resistance of Fe-Cr-Ni alloy compositions to oxidative and/or sulfidative conditions is provided by the incorporation of about 1-8 wt. % of Zr or Nb and results in a two-phase composition having an alloy matrix as the first phase and a fine grained intermetallic composition as the second phase. The presence and location of the intermetallic composition between grains of the matrix provides mechanical strength, enhanced surface scale adhesion, and resistance to corrosive attack between grains of the alloy matrix at temperatures of 500.degree.-1000.degree. C.

  18. Improved oxidation sulfidation resistance of Fe-Cr-Ni alloys

    DOEpatents

    Natesan, K.; Baxter, D.J.

    1983-07-26

    High temperature resistance of Fe-Cr-Ni alloy compositions to oxidative and/or sulfidative conditions is provided by the incorporation of about 1 to 8 wt % of Zr or Nb and results in a two-phase composition having an alloy matrix as the first phase and a fine grained intermetallic composition as the second phase. The presence and location of the intermetallic composition between grains of the matrix provides mechanical strength, enhanced surface scale adhesion, and resistance to corrosive attack between grains of the alloy matrix at temperatures of 500 to 1000/sup 0/C.

  19. Magnetic induction heating of FeCr nanocrystalline alloys

    NASA Astrophysics Data System (ADS)

    Gómez-Polo, C.; Larumbe, S.; Pérez-Landazábal, J. I.; Pastor, J. M.; Olivera, J.; Soto-Armañanzas, J.

    2012-06-01

    In this work the thermal effects of magnetic induction heating in (FeCr)73.5Si13.5Cu1B9Nb3 amorphous and nanocrystalline wires were analyzed. A single piece of wire was immersed in a glass capillary filled with water and subjected to an ac magnetic field (frequency, 320 kHz). The initial temperature rise enabled the determination of the effective Specific Absorption Rate (SAR). Maximum SAR values are achieved for those samples displaying high magnetic susceptibility, where the eddy current losses dominate the induction heating behavior. Moreover, the amorphous sample with Curie temperature around room temperature displays characteristic features of self-regulated hyperthermia.

  20. Zener Relaxation Peak in an Fe-Cr-Al Alloy

    NASA Astrophysics Data System (ADS)

    Zhou, Zheng-Cun; Cheng, He-Fa; Gong, Chen-Li; Wei, Jian-Ning; Han, Fu-Sheng

    2002-11-01

    We have studied the temperature spectra of internal friction and relative dynamic modulus of the Fe-(25 wt%)Cr-(5 wt%)Al alloy with different grain sizes. It is found that a peak appears in the internal friction versus temperature plot at about 550°C. The peak is of a stable relaxation and is reversible, which occurs not only during heating but also during cooling. Its activation energy is 2.5 (+/- 0.15) eV in terms of the Arrhenius relation. In addition, the peak is not obvious in specimens with a smaller grain size. It is suggested that the peak originates from Zener relaxation.

  1. Application of damping mechanism model and stacking fault probability in Fe-Mn alloy

    SciTech Connect

    Huang, S.K.; Wen, Y.H.; Li, N. Teng, J.; Ding, S.; Xu, Y.G.

    2008-06-15

    In this paper, the damping mechanism model of Fe-Mn alloy was analyzed using dislocation theory. Moreover, as an important parameter in Fe-Mn based alloy, the effect of stacking fault probability on the damping capacity of Fe-19.35Mn alloy after deep-cooling or tensile deformation was also studied. The damping capacity was measured using reversal torsion pendulum. The stacking fault probability of {gamma}-austenite and {epsilon}-martensite was determined by means of X-ray diffraction (XRD) profile analysis. The microstructure was observed using scanning electronic microscope (SEM). The results indicated that with the strain amplitude increasing above a critical value, the damping capacity of Fe-19.35Mn alloy increased rapidly which could be explained using the breakaway model of Shockley partial dislocations. Deep-cooling and suitable tensile deformation could improve the damping capacity owning to the increasing of stacking fault probability of Fe-19.35Mn alloy.

  2. Effects of Grit Blasting and Annealing on the High-Temperature Oxidation Behavior of Austenitic and Ferritic Fe-Cr Alloys

    NASA Astrophysics Data System (ADS)

    Proy, M.; Utrilla, M. V.; Otero, E.; Bouchaud, B.; Pedraza, F.

    2014-08-01

    Grit blasting (corundum) of an austenitic AISI 304 stainless steel (18Cr-8Ni) and of a low-alloy SA213 T22 ferritic steel (2.25Cr-1Mo) followed by annealing in argon resulted in enhanced outward diffusion of Cr, Mn, and Fe. Whereas 3 bar of blasting pressure allowed to grow more Cr2O3 and Mn x Cr3- x O4 spinel-rich scales, higher pressures gave rise to Fe2O3-enriched layers and were therefore disregarded. The effect of annealing pre-oxidation treatment on the isothermal oxidation resistance was subsequently evaluated for 48 h for both steels and the results were compared with their polished counterparts. The change of oxidation kinetics of the pre-oxidized 18Cr-8Ni samples at 850 °C was ascribed to the growth of a duplex Cr2O3/Mn x Cr3- x O4 scale that remained adherent to the substrate. Such a positive effect was less marked when considering the oxidation kinetics of the 2.25Cr-1Mo steel but a more compact and thinner Fe x Cr3- x O4 subscale grew at 650 °C compared to that of the polished samples. It appeared that the beneficial effect is very sensitive to the experimental blasting conditions. The input of Raman micro-spectroscopy was shown to be of ground importance in the precise identification of multiple oxide phases grown under the different conditions investigated in this study.

  3. The synthesis of open-shell, bimetallic Mn/Fe trinuclear clusters

    PubMed Central

    Powers, Tamara M.; Gu, Nina; Fout, Alison R.; Baldwin, Anne M.; Sánchez, Raúl Hernández; Alfonso, Denise M.; Chen, Yu-Sheng; Zheng, Shao-Liang

    2013-01-01

    Concomitant deprotonation and metallation of hexadentate ligand platform tbsLH6 (tbsLH6 = 1,3,5-C6H9(NHC6H4-o-NHSiMe2 tBu)3) with divalent transition metal starting materials Fe2(Mes)4 (Mes = mesityl) or Mn3(Mes)6 in the presence of tetrahydrofuran (THF) resulted in isolation of homotrinuclear complexes (tbsL)Fe3(THF) and (tbsL)Mn3(THF) respectively. In the absence of coordinating solvent (THF) the deprotonation and metallation exclusively afforded dinuclear complexes of the type (tbsLH2)M2 (M = Fe or Mn). The resulting dinuclear species were utilized as synthons to prepare bimetallic trinuclear clusters. Treatment of (tbsLH2)Fe2 complex with divalent Mn source (Mn2(N(SiMe3)2)4) afforded the bimetallic complex (tbsL)Fe2Mn(THF) which established the ability of hexamine ligand tbsLH6 to support mixed metal clusters. The substitutional homogeneity of (tbsL)Fe2Mn(THF) was determined by 1H NMR, 57Fe Mössbauer, and X-ray fluorescence. Anomalous scattering measurements were critical for the unambiguous assignment of the trinuclear core composition. Heating a solution of (tbsLH2)Mn2 with a stoichiometric amount of Fe2(Mes)4 (0.5 mol equiv) affords a mixture of both (tbsL)Mn2Fe(THF) and (tbsL)Fe2Mn(THF) as a result of the thermodynamic preference for heavier metal substitution within the hexa-anilido ligand framework. These results demonstrate for the first time the assembly of mixed metal cluster synthesis in an unbiased ligand platform. PMID:23984911

  4. {sup 53}Mn-{sup 53}Cr CHRONOMETRY OF CB CHONDRITE: EVIDENCE FOR UNIFORM DISTRIBUTION OF {sup 53}Mn IN THE EARLY SOLAR SYSTEM

    SciTech Connect

    Yamashita, Katsuyuki; Yamakawa, Akane; Nakamura, Eizo; Maruyama, Seiji

    2010-11-01

    High-precision Cr isotope ratios for chondrules and metal grain separated from CB chondrite Gujba were determined. The {epsilon}{sup 54}Cr values ({epsilon}{sup i}Cr = [({sup i}Cr/{sup 52}Cr){sub sample}/({sup i}Cr/{sup 52}Cr){sub standard} - 1] x 10{sup 4}) for all samples were identical within the analytical uncertainty, with a mean value of +1.29 {+-} 0.02. Uniform {epsilon}{sup 54}Cr signatures of both chondrules and metal grains imply that the Cr isotope systematics of the meteorite was once completely equilibrated. The {epsilon}{sup 53}Cr values of the chondrules and metal grain, on the other hand, display a strong correlation with the {sup 55}Mn/{sup 52}Cr ratio. The {sup 53}Mn/{sup 55}Mn calculated from the slope of the isochron is (3.18 {+-} 0.52) x 10{sup -6}. This corresponds to absolute ages of 4563.7 {+-} 1.2 Ma and 4563.5 {+-} 1.1 Ma using angrites D'Orbigny and LEW 86010, respectively, as time anchors. These ages are consistent with the ages obtained using other short- and long-lived radio nuclides, supporting the uniform distribution of {sup 53}Mn in the early solar nebula.

  5. Magnetism and electronic structure of CoFeCrX (X = Si, Ge) Heusler alloys

    NASA Astrophysics Data System (ADS)

    Jin, Y.; Kharel, P.; Lukashev, P.; Valloppilly, S.; Staten, B.; Herran, J.; Tutic, I.; Mitrakumar, M.; Bhusal, B.; O'Connell, A.; Yang, K.; Huh, Y.; Skomski, R.; Sellmyer, D. J.

    2016-08-01

    The structural, electronic, and magnetic properties of CoFeCrX (X = Si, Ge) Heusler alloys have been investigated. Experimentally, the alloys were synthesized in the cubic L21 structure with small disorder. The cubic phase of CoFeCrSi was found to be highly stable against heat treatment, but CoFeCrGe disintegrated into other new compounds when the temperature reached 402 °C (675 K). Although the first-principle calculation predicted the possibility of tetragonal phase in CoFeCrGe, the tetragonal phase could not be stabilized experimentally. Both CoFeCrSi and CoFeCrGe compounds showed ferrimagnetic spin order at room temperature and have Curie temperatures (TC) significantly above room temperature. The measured TC for CoFeCrSi is 790 K but that of CoFeCrGe could not be measured due to its dissociation into new compounds at 675 K. The saturation magnetizations of CoFeCrSi and CoFeCrGe are 2.82 μB/f.u. and 2.78 μB/f.u., respectively, which are close to the theoretically predicted value of 3 μB/f.u. for their half-metallic phases. The calculated band gaps for CoFeCrSi and CoFeCrGe are, respectively, 1 eV and 0.5 eV. These materials have potential for spintronic device applications, as they exhibit half-metallic electronic structures with large band gaps, and Curie temperatures significantly above room temperature.

  6. Sliding wear, toughness and microstructural relationships in high strength Fe/Cr/C experimental steels

    SciTech Connect

    Salesky, W.J.

    1980-06-01

    Hardness has been believed to be the major parameter influencing wear resistance of materials. Recently, it was suggested that combinations of high strength and toughness may lead to optimum wear resistance. It is known that the martensite transformation can be exploited to provide a variety of strength-toughness combinations. Small additions of Mn or Ni to the Fe/4Cr/.3C martensitic alloys have been shown to increase toughness while maintaining strength via increasing the volume fraction of retained austenite. An investigation of the relationships between microstructure, toughness, and sliding wear resistance for these experimental alloys is reported. Comparative studies were performed on several industrial alloys to provide a practical basis for comparison of these medium carbon experimental steels.

  7. Sulfur evolution in chemical looping combustion of coal with MnFe2O4 oxygen carrier.

    PubMed

    Wang, Baowen; Gao, Chuchang; Wang, Weishu; Zhao, Haibo; Zheng, Chuguang

    2014-05-01

    Chemical looping combustion (CLC) of coal has gained increasing attention as a novel combustion technology for its advantages in CO2 capture. Sulfur evolution from coal causes great harm from either the CLC operational or environmental perspective. In this research, a combined MnFe2O4 oxygen carrier (OC) was synthesized and its reaction with a typical Chinese high sulfur coal, Liuzhi (LZ) bituminous coal, was performed in a thermogravimetric analyzer (TGA)-Fourier transform infrared (FT-IR) spectrometer. Evolution of sulfur species during reaction of LZ coal with MnFe2O4 OC was systematically investigated through experimental means combined with thermodynamic simulation. TGA-FTIR analysis of the LZ reaction with MnFe2O4 indicated MnFe2O4 exhibited the desired superior reactivity compared to the single reference oxides Mn3O4 or Fe2O3, and SO2 produced was mainly related to oxidization of H2S by MnFe2O4. Experimental analysis of the LZ coal reaction with MnFe2O4, including X-ray diffraction and X-ray photoelectron spectroscopy analysis, verified that the main reduced counterparts of MnFe2O4 were Fe3O4 and MnO, in good agreement with the related thermodynamic simulation. The obtained MnO was beneficial to stabilize the reduced MnFe2O4 and avoid serious sintering, although the oxygen in MnO was not fully utilized. Meanwhile, most sulfur present in LZ coal was converted to solid MnS during LZ reaction with MnFe2O4, which was further oxidized to MnSO4. Finally, the formation of both MnS and such manganese silicates as Mn2SiO4 and MnSiO3 should be addressed to ensure the full regeneration of the reduced MnFe2O4.

  8. Ferromagnetic resonance study of the misalignment between anisotropy axes in exchange-biased NiFe/FeMn/Co trilayers

    NASA Astrophysics Data System (ADS)

    Barreto, P. G.; Sousa, M. A.; Pelegrini, F.; Alayo, W.; Litterst, F. J.; Baggio-Saitovitch, E.

    2014-05-01

    Exchange-biased NiFe/FeMn/Co trilayers were grown by dc magnetron sputtering and analyzed by in-plane ferromagnetic resonance using Q-band microwaves. The experiments revealed that distinct Co and NiFe resonance modes were excited by the microwave field. A misalignment between the anisotropy axes of the magnetic layers was deduced from the angular variations of the resonance fields, which also showed the effects of uniaxial and unidirectional anisotropies. A phenomenological model was used to fit the experimental results taking also into account a rotatable anisotropy field associated to the domain structure of the FeMn layer and the magnetic history of the films.

  9. Magnetic patterning of Fe/Cr/Fe(001) trilayers by Ga{sup +} ion irradiation

    SciTech Connect

    Blomeier, S.; Hillebrands, B.; Demidov, V.E.; Demokritov, S.O.; Reuscher, B.; Brodyanski, A.; Kopnarski, M.

    2005-11-01

    Magnetic patterning of antiferromagnetically coupled epitaxial Fe (10 nm)/Cr (0.7 nm)/Fe (10 nm) (001) trilayers by irradiation with 30 keV Ga{sup +} ions was studied by means of atomic force microscopy, magnetic force microscopy, and Kerr magnetometry. It was found that within a fluence range of (1.25-5)x10{sup 16} ions/cm{sup 2} a complete transition from antiferromagnetic to ferromagnetic coupling between the two Fe layers can be achieved. The magnetization reversal processes of the nonirradiated, antiferromagnetically coupled areas situated close to the irradiated areas were studied with lateral resolution. Evidence for a lateral coupling mechanism between the magnetic moments of the irradiated and nonirradiated areas was found. Special attention was paid to preserve the flatness of the irradiated samples. Depending on the fluence, topographic steps ranging from +1.5 to -2 nm between the nonirradiated and irradiated areas were observed. At lower fluences the irradiation causes an increase of the surface height, while for higher fluences the height decreases. It was found that for the particular fluence of 2.7x10{sup 16} ions/cm{sup 2} no height difference between the irradiated and nonirradiated areas occurs. The results suggest that the irradiation of Fe/Cr/Fe trilayers with midenergy ions is an innovative method for magnetic patterning, preserving the initial smoothness of the sample.

  10. Dilute ferrimagnetism of ilmenites Mn3FeTiSbO9 and Mn4FeTi2SbO12

    NASA Astrophysics Data System (ADS)

    Bazuev, G. V.; Korolev, A. V.; Golovkin, B. G.

    2016-07-01

    Metastable solid solutions (SS) Mn3FeTiSbO9 and Mn4FeTi2SbO12 with the ilmenite structure (space group R bar 3) have been prepared by quenching at normal conditions. The compositions of the compounds have been justified using EDX spectroscopy and X-ray diffraction. The magnetic properties of SSs have been analyzed by comparison with ferrimagnetic ilmenite Mn2FeSbO6 ( T N = 269 K) as a natural mineral and ceramics obtained at high pressure and high temperature. The solid solutions have been characterized as dilute magnetic systems formed as a result of substitution of nonmagnetic cations Ti4+ for a part of Fe3+ and Sb5+ cations. Mn3FeTiSbO9 is considered as a ferromagnetic with T N = 171 K and Mn4FeTi2SbO12 as a magnetic with the concentration of magnetic clusters below the percolation threshold.

  11. Influence of substrate rocks on Fe-Mn crust composition

    USGS Publications Warehouse

    Hein, J.R.; Morgan, C.L.

    1999-01-01

    Principal Component and other statistical analyses of chemical and mineralogical data of Fe-Mn oxyhydroxide crusts and their underlying rock substrates in the central Pacific indicate that substrate rocks do not influence crust composition. Two ridges near Johnston Atoll were dredged repetitively and up to seven substrate rock types were recovered from small areas of similar water depths. Crusts were analyzed mineralogically and chemically for 24 elements, and substrates were analyzed mineralogically and chemically for the 10 major oxides. Compositions of crusts on phosphatized substrates are distinctly different from crusts on substrates containing no phosphorite. However, that relationship only indicates that the episodes of phosphatization that mineralized the substrate rocks also mineralized the crusts that grew on them. A two-fold increase in copper contents in crusts that grew on phosphatized clastic substrate rocks, relative to crusts on other substrate rock types, is also associated with phosphatization and must have resulted from chemical reorganization during diagenesis. Phosphatized crusts show increases in Sr, Zn, Ca, Ba, Cu, Ce, V, and Mo contents and decreases in Fe, Si, and As contents relative to non-phosphatized crusts. Our statistical results support previous studies which show that crust compositions reflect predominantly direct precipitation from seawater (hydrogenetic), and to lesser extents reflect detrital input and diagenetic replacement of parts of the older crust generation by carbonate fluorapatite.

  12. Magnetic interaction reversal in watermelon nanostructured Cr-doped Fe nanoclusters

    SciTech Connect

    Kaur, Maninder; Dai, Qilin; Bowden, Mark; Engelhard, Mark; Wu, Yaqiao; Tang, Jinke; Qiang, You

    2013-01-01

    Cr-doped core-shell Fe/Fe-oxide nanoclusters (NCs) were synthesized at varied atomic percentages of Cr from 0 at. % to 8 at. %. The low concentrations of Cr (<10 at. %) were selected in order to inhibit the complete conversion of the Fe-oxide shell to Cr2O3 and the Fe core to FeCr alloy. The magnetic interaction in Fe/Fe-oxide NCs (rv25 nm) can be controlled by antiferromagnetic Cr-dopant. We report the origin of r-FeCr phase at very low Cr concentration (2 at. %) unlike in previous studies, and the interaction reversal from dipolar to exchange interaction in watermelon-like Cr-doped core-shell NCs. The giant magnetoresistance (GMR) effect,1,2 where an antiferromagnetic (AFM) exchange coupling exists between two ferromagnetic (FM) layers separated by a certain type of magnetic or non-magnetic spacer,3 has significant potential for application in the magnetic recording industry. Soon after the discovery of the GMR, the magnetic properties of multilayer systems (FeCr) became a subject of intensive study. The application of bulk iron-chromium (Fe-Cr) alloys has been of great interest, as these alloys exhibit favorable prop- erties including corrosion resistance, high strength, hardness, low oxidation rate, and strength retention at elevated temper- ature. However, the structural and magnetic properties of Cr-doped Fe nanoclusters (NCs) have not been investigated in-depth. Of all NCs, Fe-based clusters have unique magnetic properties as well as favorable catalytic characteristics in reactivity, selectivity, and durability.4 The incorporation of dopant of varied type and concentration in Fe can modify its chemical ordering, thereby optimizing its electrical, optical, and magnetic properties and opening up many new applications. The substitution of an Fe atom (1.24 A°) by a Cr atom (1.25 A° ) can easily modify the magnetic properties, since (i) the curie temperature (Tc ) of Fe is 1043 K, while Cr is an itinerant AFM with a bulk Neel temperature TN =311 K, and (ii) Fe

  13. Contribution of di-SIA to mass transport in Fe-Cr alloys

    NASA Astrophysics Data System (ADS)

    Ryabov, V. A.; Pechenkin, V. A.; Molodtsov, V. L.; Terentyev, D.

    2016-04-01

    Molecular dynamics simulations have been performed to study the diffusion characteristics of di-self interstitial atom (di-SIA) in BCC Fe-Cr alloys and corresponding mass transport of Fe and Cratoms in the temperature range 600-1000 K in the alloys with Cr content 5-25 at%, which is relevant for ferritic/martensitic steels. An original treatment is proposed in this work to account for a mixed migration mode composed of the diffusion of the cluster itself and break-up into a pair of independent SIAs. The ratio of self-diffusion coefficients of Cr and Fe is found to exceed unity in Fe-5Cr and Fe-10Cr alloys, which implies that under cascade-producing damage, 3D-migrating small SIA clusters will effectively contribute to the segregation of Cr to neutral and SIA-preferential sinks, eventually causing radiation induced segregation.

  14. Synthesis and characterization of Cr doped CoFe2O4

    NASA Astrophysics Data System (ADS)

    Verma, Kavita; Patel, K. R.; Ram, Sahi; Barbar, S. K.

    2016-05-01

    Polycrystalline samples of pure and Cr-doped cobalt ferrite (CoFe2O4 and CoCrFeO4) were prepared by solid state reaction route method. X-ray diffraction pattern infers that both the samples are in single phase with Fd3m space group. Slight reduction in the lattice parameter of CoCrFeO4 has been observed as compared to CoFe2O4. The dielectric dispersion has been explained on the basis of Fe2+ ↔ Fe3+ hopping mechanism. The polarizations at lower frequencies are mainly attributed to electronic exchange between Fe2+ ↔ Fe3+ ions on the octahedral site in the ferrite lattice. In the present system a part from n-type charge carrier (Fe3+/Fe2+), the presence of (Co3+/Co2+) ions give rise to p-type charge carrier. Therefore in addition to n-type charge carrier, the local displacement of p-type charge carrier in direction of external electric field also contributes to net polarization. However, the dielectric constant and loss tangent of CoCrFeO4 are found to be lower than CoFe2O4 and is attributed to the availability of ferrous ion. CoCrFeO4 have less amount of ferrous ion available for polarization as compared to that of CoFe2O4. The impedance spectra reveal a grain interior contribution to the conduction process.

  15. Surface half-metallicity of half-Heusler compound FeCrSe and interface half-metallicity of FeCrSe/GaP

    NASA Astrophysics Data System (ADS)

    Khalaf Al-zyadi, Jabbar M.; Jolan, Mudhahir H.; Yao, Kai-Lun

    2016-04-01

    Recent studies showed that half-Heusler FeCrSe exhibits half-metallic ferromagnetism (Huang et al. [20]). In this paper, we investigate extensively the electronic, magnetic, and half-metallic properties of the half-Heusler alloy FeCrSe (111) and (001) surfaces and the interface with GaP (111) substrate by using the first-principles calculations within the density functional theory. The atomic density of states demonstrates that the half-me tallicity verified in the bulk FeCrSe is maintained at the CrSe-terminated (001) and Se-terminated (111) surfaces, but lost at both Cr- and Fe-terminated (111) surfaces and the Fe-terminated (001) surface. Alternatively, for the interface of FeCrSe/GaP (111), the bulk half-metallicity is destroyed at Se-P configuration while Se-Ga interface and subinterface show nearly 100% spin polarization. Moreover, the calculated interfacial adhesion energies exhibit that Se-Ga shape is more stable than the Se-P one. The calculated magnetic moments of Se, Ga at the Se-Ga (111) interface and P at the Se-P (111) interface increase with respect to the corresponding bulk values while the atomic magnetic moment of Se atom at the Se-P (111) interface decreases. We also notice that the magnetic moments of subinterface Fe at both Se-Ga and Se-P (111) interfaces decrease compared to the bulk values.

  16. Letter Report Documenting Progress of Second Generation ATF FeCrAl Alloy Fabrication

    SciTech Connect

    Yamamoto, Y.; Yang, Y.; Field, K. G.; Terrani, K.; Pint, B. A.; Snead, L. L.

    2014-06-10

    Development of the 2nd generation ATF FeCrAl alloy has been initiated, and a candidate alloy was selected for trial tube fabrication through hot-extrusion and gun-drilling processes. Four alloys based on Fe-13Cr-4.5Al-0.15Y in weight percent were newly cast with minor alloying additions of Mo, Si, Nb, and C to promote solid-solution and second-phase precipitate strengthening. The alloy compositions were selected with guidance from computational thermodynamic tools. The lab-scale heats of ~ 600g were arc-melted and drop-cast, homogenized, hot-forged and -rolled, and then annealed producing plate shape samples. An alloy with Mo and Nb additions (C35MN) processed at 800°C exhibits very fine sub-grain structure with the sub-grain size of 1-3μm which exhibited more than 25% better yield and tensile strengths together with decent ductility compared to the other FeCrAl alloys at room temperature. It was found that the Nb addition was key to improving thermal stability of the fine sub-grain structure. Optimally, grains of less than 30 microns are desired, with grains up to and order of magnitude in desired produced through Nb addition. Scale-up effort of the C35MN alloy was made in collaboration with a commercial cast company who has a capability of vacuum induction melting. A 39lb columnar ingot with ~81mm diameter and ~305mm height (with hot-top) was commercially cast, homogenized, hot-extruded, and annealed providing 10mm-diameter bar-shape samples with the fine sub-grain structure. This commercial heat proved consistent with materials produced at ORNL at the lab-scale. Tubes and end caps were machined from the bar sample and provided to another work package for the ATF-1 irradiation campaign in the milestone M3FT-14OR0202251.

  17. Thermal stability of intermetallic phases in Fe-rich Fe-Cr-Ni-Mo alloys

    SciTech Connect

    Yang, Ying; Tan, Lizhen; Busby, Jeremy T.

    2015-06-12

    Understanding the stability of precipitate phases in the Fe-rich Fe-Cr-Ni-Mo alloys is critical to the alloy design and application of Mo-containing Austenitic steels. Coupled with thermodynamic modeling, stability of the chi and Laves phases in two Fe-Cr-Ni-Mo alloys were investigated at 1000, 850 and 700 °C for different annealing time. The morphologies, compositions and crystal structures of the matrix and precipitate phases were carefully examined by Scanning Electron Microscopy, Electron Probe Microanalysis, X-ray diffraction and Transmission Electron Microscopy. The two key findings resulted from this work. One is that the chi phase is stable at high temperature and transformed into the Laves phase at low temperature. The other is that both the chi and Laves phases have large solubilites of Cr, Mo and Ni, among which the Mo solubility has a major role on the relative stability of the precipitate phases. The developed thermodynamic models were then applied to evaluating the Mo effect on the stability of precipitate phases in AISI 316 and NF709 alloys.

  18. Thermal stability of intermetallic phases in Fe-rich Fe-Cr-Ni-Mo alloys

    DOE PAGESBeta

    Yang, Ying; Tan, Lizhen; Busby, Jeremy T.

    2015-06-12

    Understanding the stability of precipitate phases in the Fe-rich Fe-Cr-Ni-Mo alloys is critical to the alloy design and application of Mo-containing Austenitic steels. Coupled with thermodynamic modeling, stability of the chi and Laves phases in two Fe-Cr-Ni-Mo alloys were investigated at 1000, 850 and 700 °C for different annealing time. The morphologies, compositions and crystal structures of the matrix and precipitate phases were carefully examined by Scanning Electron Microscopy, Electron Probe Microanalysis, X-ray diffraction and Transmission Electron Microscopy. The two key findings resulted from this work. One is that the chi phase is stable at high temperature and transformed intomore » the Laves phase at low temperature. The other is that both the chi and Laves phases have large solubilites of Cr, Mo and Ni, among which the Mo solubility has a major role on the relative stability of the precipitate phases. The developed thermodynamic models were then applied to evaluating the Mo effect on the stability of precipitate phases in AISI 316 and NF709 alloys.« less

  19. Impact of Mn on the solution enthalpy of hydrogen in austenitic Fe-Mn alloys: a first-principles study.

    PubMed

    von Appen, Jörg; Dronskowski, Richard; Chakrabarty, Aurab; Hickel, Tilmann; Spatschek, Robert; Neugebauer, Jörg

    2014-12-01

    Hydrogen interstitials in austenitic Fe-Mn alloys were studied using density-functional theory to gain insights into the mechanisms of hydrogen embrittlement in high-strength Mn steels. The investigations reveal that H atoms at octahedral interstitial sites prefer a local environment containing Mn atoms rather than Fe atoms. This phenomenon is closely examined combining total energy calculations and crystal orbital Hamilton population analysis. Contributions from various electronic phenomena such as elastic, chemical, and magnetic effects are characterized. The primary reason for the environmental preference is a volumetric effect, which causes a linear dependence on the number of nearest-neighbour Mn atoms. A secondary electronic/magnetic effect explains the deviations from this linearity.

  20. Preparation of Al-Cr-Fe Coatings by Heat Treatment of Electrodeposited Cr/Al Composite Coatings

    NASA Astrophysics Data System (ADS)

    Zhang, Min; Chen, Chang'an; Zhang, Guikai; Rao, Yongchu; Ling, Guoping

    Al-Cr-Fe coatings have been widely used in the surface engineering field of materials, due to their excellent corrosion resistance to water vapor and fused salt deposits. In this study, a new two-step approach was developed to prepare Al-Cr-Fe coatings on surfaces of SUS430 stainless steels. First, the Cr/Al composite coatings were prepared by electrodepositing Cr from aqueous solution then electrodepositing Al from AlCl3-1-ethyl-3-methyl-imidazolium chloride (AlCl3-EMIC) ionic liquid on SUS430 stainless steel substrate. In the second, heat treatment of the Cr/Al composite coatings was carried out to acquire Al-Cr-Fe coatings. Effects of the thickness of Cr/Al composite coatings, the time and temperature of heat treatment on composition and phase structure of alloy layers were studied by using scanning electron microscope (SEM), backscattered electron (BSE), energy dispersive spectroscopy (EDS) and X-ray diffraction (XRD). The structure transformation process and formation mechanism of Al-Cr-Fe coatings were discussed.

  1. Antiferromagnetic FeMn alloys electrodeposited from chloride-based electrolytes.

    PubMed

    Ruiz-Gómez, Sandra; Ranchal, Rocío; Abuín, Manuel; Aragón, Ana María; Velasco, Víctor; Marín, Pilar; Mascaraque, Arantzazu; Pérez, Lucas

    2016-03-21

    The capability of synthesizing Fe-based antiferromagnetic metal alloys would fuel the use of electrodeposition in the design of new magnetic devices such as high-aspect-ratio spin valves or new nanostructured hard magnetic composites. Here we report the synthesis of high quality antiferromagnetic FeMn alloys electrodeposited from chloride-based electrolytes. We have found that in order to grow homogeneous FeMn films it is necessary to incorporate a large concentration of NH4Cl as an additive in the electrolyte. The study of the structure and magnetic properties shows that films with composition close to Fe50Mn50 are homogeneous antiferromagnetic alloys. We have established a parameter window for the synthesis of FeMn alloys that show antiferromagnetism at room temperature.

  2. Dual and Triple Ion-Beam Irradiations of Fe, Fe(Cr) and Fe(Cr)-ODS Final Report: IAEA SMoRE CRP

    SciTech Connect

    Fluss, M J; Hsiung, L L; Marian, J

    2011-11-20

    Structures of nanoparticles in Fe-16Cr-4.5Al-0.3Ti-2W-0.37Y2O3 (K3) and Fe-20Cr-4.5Al-0.34Ti-0.5Y2O3 (MA956) oxide dispersion strengthened (ODS) ferritic steels produced by mechanical alloying (MA) and followed by hot extrusion have been studied using high-resolution transmission electron microscopy (HRTEM) techniques to gain insight about the formation mechanism of nanoparticles in MA/ODS steels. The observations of Y-Al-O complex-oxide nanoparticles in both ODS steels imply that decomposition of Y2O3 in association with internal oxidation of Al occurred during mechanical alloying. While the majority of oxide nanoparticles formed in both steels is Y4Al2O9, a few oxide particles of YAlO3 are also occasionally observed. These results reveal that Ti (0.3 wt %) plays an insignificant role in forming oxide nanoparticles in the presence of Al (4.5 wt %). HRTEM observations of crystalline nanoparticles larger than {approx}2 nm and amorphous or disordered cluster domains smaller than {approx}2 nm provide an insight into the formation mechanism of oxide nanoparticle in MA/ODS steels, which we believe from our observations involves a solid-state amorphous precursor followed by recrystallization. Dual ion-beam irradiations using He{sup +} + Fe{sup +8} ions were employed to gain more detailed insight about the role of nanoparticles in suppressing radiation-induced swelling. This is elaborated through TEM examinations of cavity distributions in ion-irradiated Fe-14Cr and K3-ODS ferritic steels. HRTEM observations of helium-filled cavities (helium bubbles) preferably trapped at nanoscale oxide particles and clusters in ion-irradiated K3-ODS are presented. Finally, we describe the results from triple ion-beam irradiations using H{sup +} + He{sup +} + Fe{sup +8} ions to emulate fusion first wall radiation effects. Preliminary work is reported that confirms the existence of significant hydrogen synergistic effects described earlier by Tanaka et al., for Fe(Cr) and by Wakai et al

  3. In-trap decay of 61Mn and Coulomb excitation of 61Mn/61Fe

    NASA Astrophysics Data System (ADS)

    van de Walle, J.; Bildstein, V.; Bree, N.; Cederkäll, J.; Delahaye, P.; Diriken, J.; Ekström, A.; Fedosseev, V. N.; Gernhäuser, R.; Gustafsson, A.; Herlert, A.; Huyse, M.; Ivanov, O.; Kröll, T.; Krücken, R.; Marsh, B.; Partronis, N.; van Duppen, P.; Voulot, D.; Warr, N.; Wenander, F.; Wimmer, K.; Lenzi, S. M.

    2009-12-01

    At ISOL (Isotope Separator On-Line) facilities, which utilize thick primary production targets, beams of neutron-rich iron isotopes are difficult to obtain due to the long extraction time of these isotopes out of the target matrix. At REX-ISOLDE, an exploratory experiment was carried out to investigate the possibility of producing a post-accelerated beam of neutron-rich iron isotopes by the in-trap decay of neutron-rich manganese isotopes, which are available at ISOLDE using the Resonance Ionization Laser Ion Source (RILIS). This production mechanism was tested for the first time at REX-ISOLDE with an intense and short-lived beam of 61Mn isotopes. In this work, the proof of principle of this method is demonstrated, although the technical details of the trapping process are currently not well understood and are still under investigation. The first physics results on the Coulomb excitation of 61Mn and 61Fe are presented and compared to shell model calculations.

  4. Adsorption of Mn2+ from aqueous solution using Fe and Mn oxide-coated sand.

    PubMed

    Kan, Chi-Chuan; Aganon, Mannie C; Futalan, Cybelle Morales; Dalida, Maria Lourdes P

    2013-07-01

    The adsorption of Mn2+ onto immobilized Mn-oxide and Fe-oxide adsorbent such as manganese oxide-coated sandl (MOCS1), manganese oxide-coated sand2 (MOCS2), iron oxide-coated sand2 (IOCS2), and manganese and iron oxide-coated sand (MIOCS) was investigated. The effects of pH (5.5 to 8.0) and temperature (25 to 45 degrees C) on the equilibrium capacity were examined. Equilibrium studies showed that there is a good fit with both Freundlich and Langmuir isotherm, which indicates surface heterogeneity and monolayer adsorption of the adsorbents. Kinetic data showed high correlation with the pseudo second-order model, which signifies a chemisorption-controlled mechanism. The activation energies, activation parameters (deltaG, deltaH, deltaS), and thermodynamic parameters (deltaG0, deltaH0, deltaS0) confirmed that adsorption with MIOCS was endothermic and more spontaneous at higher temperature while an opposite trend was observed for the other adsorbents. Thermodynamic studies showed that adsorption involved formation of activated complex, where MOCS 1 and MIOCS follow a physical-chemical mechanism, while MOCS2 and IOCS2 follows purely chemical mechanism. PMID:24218863

  5. Optical properties of heusler alloys Co2FeSi, Co2FeAl, Co2CrAl, and Co2CrGa

    NASA Astrophysics Data System (ADS)

    Shreder, E. I.; Svyazhin, A. D.; Belozerova, K. A.

    2013-11-01

    The results of an investigation of optical properties and the calculations of the electronic structure of Co2FeSi, Co2FeAl, Co2CrAl, and Co2CrGa Heusler alloys are presented. The main focus of our attention is the study of the spectral dependence of the real part (ɛ1) and imaginary part (ɛ2) of the dielectric constant in the range of wavelengths λ = 0.3-13 μm using the ellipsometric method. An anomalous behavior of the optical conductivity σ(ω) has been found in the infrared range in the Co2CrAl and Co2CrGa alloys, which differs substantially from that in the Co2FeSi and Co2FeAl alloys. The results obtained are discussed based on the calculations of the electronic structure.

  6. Ab initio study of Fe{sub 2}MnZ (Al, Si, Ge) Heusler alloy using GGA approximation

    SciTech Connect

    Jain, Vivek Kumar Jain, Vishal Lakshmi, N. Venugopalan, K.

    2014-04-24

    Density functional theory based on FP-LAPW method used to investigate the electronic structure of Fe{sub 2}MnZ, shows that the total spin magnetic moment shows a trend consistent with the Slater–Pauling curve. The Fe and Mn magnetic moment depend on choice of Z element although the magnetic moment of Z element is negative and less than 0.1 μ{sub B}. Spin polarization calculations evidence 100% spin polarization for Fe{sub 2}MnSi. Fe{sub 2}MnAl and Fe{sub 2}MnGe show metallic behavior with 93%, 98% spin polarization.

  7. Structural and magnetic properties of (Fe/Mn) exchange-biased multilayers

    NASA Astrophysics Data System (ADS)

    El Bahoui, A.; Genevois, C.; Juraszek, J.; Bordel, C.; Ledue, D.

    2013-05-01

    Exchange-biasing of ferromagnetic (F) Fe layers by adjacent antiferromagnetic (AF) Mn layers has been investigated in (Fe/Mn)10 multilayered films. This study has been focused on the relationship between the evolution of the exchange-bias field and the evolution of the film microstructure as a function of the deposition temperature. The increase of the deposition temperature results in the formation of an Fe-Mn alloy at the interfaces and columnar features whose size increases with the deposition temperature. In parallel, the exchange-bias field decreases significantly, due to interface roughness.

  8. Ni spin switching induced by magnetic frustration in FeMn/Ni/Cu(001)

    SciTech Connect

    Wu, J.; Choi, J.; Scholl, A.; Doran, A.; Arenholz, E.; Hwang, Chanyong; Qiu, Z. Q.

    2009-03-08

    Epitaxially grown FeMn/Ni/Cu(001) films are investigated by Photoemission Electron Microscopy and Magneto-Optic Kerr Effect. We find that as the FeMn overlayer changes from paramagnetic to antiferromagnetic state, it could switch the ferromagnetic Ni spin direction from out-of-plane to in-plane direction of the film. This phenomenon reveals a new mechanism of creating magnetic anisotropy and is attributed to the out-of-plane spin frustration at the FeMn-Ni interface.

  9. Study of the structural and magnetic properties and gallium exchange phenomenon in a Mn-Ga alloy doped by Cr during the milling and annealing process

    NASA Astrophysics Data System (ADS)

    Fariba, Nazari; Mohsen, Hakimi; Hossein, Mokhtari; Mohsen, Khajeh Aminian

    2015-05-01

    The effect of milling and annealing process on Cr doped Mn3Ga nanocrystallite has been investigated. Phase determination analysis shows that Ga turning to get out of Mn-Ga structure and tend to make bonding to Cr and form Cr3Ga4 product during milling process. Annealing of the new phases lead to decomposition of Cr3Ga4 and formation of a new Mn-Ga phase in reverse direction, in the other words diffusion of Ga atoms occurs from Cr3Ga4 to Mn phase and α-Mn and Cr3Ga4 change to Mn3Ga2 and Cr phases. The variation of coersivity, magnetization and magnetic state of different samples was explained according to the crystallite size of the present phases and grain boundary effects. It was also confirmed that formation of Mn-Cr clusters plays an important role in increase of saturation magnetization.

  10. [Spatial and temporal variation of Fe and Mn in the stormwater wetland].

    PubMed

    Chen, Qing-feng; Shan, Bao-qing; Ma, Jun-jian; Gao, Xin-guo; Ding, Shi-gang; Liu, Wei; Zhang, Jing

    2011-05-01

    To study the purification mechanism and biogeochemical cycle of wetlands, the concentration of Fe/Mn and oxidation reduction potential (ORP) in the pore water were monitored in situ on the Wuhan Zoo stormwater wetland from 2004 to 2006. The results showed that the water level of the wetland was changed from -10 cm to 30 cm, and the range of ORP was-120-220 mV. The elements of sulfur, iron and manganese were the main oxidation and reduction systems in the wetland. The ranges of total Fe, Mn and Fe2+ concentration were 0.60-2.35, 0.75-1.89 and 0.20-1.25 mg x L(-1), respectively. The concentrations of total Fe, Mn and Fe2+ were higher in spring and summer than that in autumn and winter, while the sulfate concentration was on the contrary and the ratio of Fe2+/Fe was slightly various in different seasons. From the surface of 10 cm to 50 cm underground, ORP and pH was decreased, whereas the concentrations of total Fe, Mn and Fe2+ were increased (except for the surface water). Through the correlation analysis, it was showed that the correlation of ORP and total Mn and Fe2+ was negative and significant, while there was no significant correlation between ORP and total Fe (R = -0.169, p < 0.0001). The order of the correlation coefficient was total Mn, Fe and Fe2+ in turn. Therefore, the systems of sulfur, iron and manganese were the important component of the oxidation and reduction system for stormwater wetland.

  11. Magnetic properties and loss separation in FeSi/MnZnFe2O4 soft magnetic composites

    NASA Astrophysics Data System (ADS)

    Lauda, M.; Füzer, J.; Kollár, P.; Strečková, M.; Bureš, R.; Kováč, J.; Baťková, M.; Baťko, I.

    2016-08-01

    We investigated composites that have been prepared from FeSi powders covered with MnZnFe2O4 (MnZn ferrite), which was prepared by sol-gel synthesis accompanied with the auto-combustion process. The aim of this paper is to analyze the complex permeability and core losses of prepared samples with different amount of MnZn ferrite. The microstructure and the powder morphology were examined by scanning electron microscopy. Magnetic measurements on bulk samples were carried out using a vibrating sample magnetometer, an impedance analyzer and hysteresisgraphs. The results indicate that the composites with 2.6 wt% MnZn ferrite show better soft magnetic properties than the composites with about 6 wt% MnZn ferrite.

  12. Preparation of a novel graphene oxide/Fe-Mn composite and its application for aqueous Hg(II) removal.

    PubMed

    Tang, Jingchun; Huang, Yao; Gong, Yanyan; Lyu, Honghong; Wang, Qilin; Ma, Jianli

    2016-10-01

    A novel graphene oxide/Fe-Mn (GO/Fe-Mn) composite was synthesized (molar ratio of Fe/Mn=3/1 and mass ratio of Fe/GO=1/7.5) and investigated for the sorption characteristics and mechanisms of aqueous mercury (Hg(2+)) as well as the biological effects to wheat and rice. Characterization tests showed that Fe-Mn oxides were impregnated onto GO sheets in an amorphous form through oxygen-containing functional groups (i.e., CO, epoxy COC, carboxyl OCO, and CO) and π-π interactions. GO/Fe-Mn possessed large surface area, surface enhanced Raman scattering with more sp(3) defects, and greater thermal stability than GO. XPS analysis revealed that Fe2O3, FeOOH, MnO2, MnOOH, and MnO were the dominant metal oxides in GO/Fe-Mn. Pseudo-second-order kinetic model and Sips isotherm model fitted well with the sorption kinetic and isotherm data. The maximum sorption capacity for mercury was 32.9mg/g. Ligand exchange and surface complexation were the dominant mechanisms for mercury removal. GO/Fe-Mn greatly reduced the bioavailability of mercury to wheat and rice, even promoted the seedling growth. This work suggests that GO/Fe-Mn can be used as an effective and environmental-friendly adsorbent in heavy metal remediation. PMID:27232726

  13. Preparation of a novel graphene oxide/Fe-Mn composite and its application for aqueous Hg(II) removal.

    PubMed

    Tang, Jingchun; Huang, Yao; Gong, Yanyan; Lyu, Honghong; Wang, Qilin; Ma, Jianli

    2016-10-01

    A novel graphene oxide/Fe-Mn (GO/Fe-Mn) composite was synthesized (molar ratio of Fe/Mn=3/1 and mass ratio of Fe/GO=1/7.5) and investigated for the sorption characteristics and mechanisms of aqueous mercury (Hg(2+)) as well as the biological effects to wheat and rice. Characterization tests showed that Fe-Mn oxides were impregnated onto GO sheets in an amorphous form through oxygen-containing functional groups (i.e., CO, epoxy COC, carboxyl OCO, and CO) and π-π interactions. GO/Fe-Mn possessed large surface area, surface enhanced Raman scattering with more sp(3) defects, and greater thermal stability than GO. XPS analysis revealed that Fe2O3, FeOOH, MnO2, MnOOH, and MnO were the dominant metal oxides in GO/Fe-Mn. Pseudo-second-order kinetic model and Sips isotherm model fitted well with the sorption kinetic and isotherm data. The maximum sorption capacity for mercury was 32.9mg/g. Ligand exchange and surface complexation were the dominant mechanisms for mercury removal. GO/Fe-Mn greatly reduced the bioavailability of mercury to wheat and rice, even promoted the seedling growth. This work suggests that GO/Fe-Mn can be used as an effective and environmental-friendly adsorbent in heavy metal remediation.

  14. Atomistic modelling of the Fe-Cr-C system

    NASA Astrophysics Data System (ADS)

    Wallenius, Janne; Sandberg, Nils; Henriksson, Krister

    2011-08-01

    For the purpose of modelling the impact of carbon on radiation damage phenomena in steels, we have performed an extensive set of first principle calculations on the Fe-Cr-C system. The calculated solution and diffusion enthalpies of carbon in iron and in chromium agree well with experimental data, as do the relative formation energies of mono-carbides, cementite, Hägg and M 23C 6 carbides. Our data further indicate that interstitial carbon is attracted to a solute iron atom in bcc chromium, while the reaction between carbon and a solute chromium atom in bcc iron is repulsive. An empirical potential fitted to data for iron carbides is capable of reproducing melting behaviour of cementite, while the predicted interaction with point defects agrees less well with DFT data than a potential recently published by Hepburn and Ackland.

  15. Thermodynamic Modeling of the Cr-Fe-S System

    NASA Astrophysics Data System (ADS)

    Waldner, Peter

    2014-02-01

    All known phases of the chromium-iron-sulfur ternary system are taken into consideration within a thermodynamic analysis of phase equilibria and thermodynamic data at 1 bar total pressure over the entire composition range between 298.15 K (25 °C) and temperatures greater than the liquidus. The modeling is based on recent evaluations of the Fe-S and Cr-S binary subsystems. The extended modified quasi-chemical model is applied for the liquid chromium-iron-sulfur phase. The Gibbs energy of solid solution phases as high-temperature chromium-iron pyrrhotite and the thiospinel Daubréelite is described by sublattice models within the framework of the compound energy formalism. Analysis of complex phase relations is now possible on the basis of a consistent thermodynamic description of the system. The thermodynamic modeling presented can be combined with models of other metal-sulfur systems to develop a thermodynamic multicomponent/multiphase database.

  16. Structure and properties of corrosion and wear resistant Cr-Mn-N steels

    NASA Astrophysics Data System (ADS)

    Lenel, U. R.; Knott, B. R.

    1987-06-01

    Steels containing about 12 pct Cr, 10 pct Mn, and 0.2 pct N have been shown to have an unstable austenitic microstructure and have good ductility, extreme work hardening, high fracture strength, excellent toughness, good wear resistance, and moderate corrosion resistance. A series of alloys containing 9.5 to 12.8 pct Cr, 5.0 to 10.4 pct Mn, 0.16 to 0.32 pct N, 0.05 pct C, and residual elements typical of stainless steels was investigated by microstructural examination and mechanical, abrasion, and corrosion testing. Microstructures ranged from martensite to unstable austenite. The unstable austenitic steels transformed to α martensite on deformation and displayed very high work hardening, exceeding that of Hadfield’s manganese steels. Fracture strengths similar to high carbon martensitic stainless steels were obtained while ductility and toughness values were high, similar to austenitic stainless steels. Resistance to abrasive wear exceeded that of commercial abrasion resistant steels and other stainless steels. Corrosion resistance was similar to that of other 12 pct Cr steels. Properties were not much affected by minor compositional variations or rolled-in nitrogen porosity. In 12 pct Cr-10 pct Mn alloys, ingot porosity was avoided when nitrogen levels were below 0.19 pet, and austenitic microstructures were obtained when nitrogen levels exceeded 0.14 pct.

  17. Phase stabilization of Fe substituted NdMn2O5 ceramics and their properties

    NASA Astrophysics Data System (ADS)

    Kumar, K. Saravana; Venkateswaran, C.

    2015-08-01

    An oxide of stoichiometry, NdFeMnO5, has been synthesized using a two-step process. First the precursor oxides are high-energy ball milled and the as-milled powders are then sintered to obtain the NdFeMnO5 phase. Rietveld refinement of the XRD pattern, by replacing the Mn3+ sites with Fe3+, shows the formation of stoichiometric NdFeMnO5. Nd & Mn are found to be in +3 and +4 states, respectively from the XPS study. Agglomeration of fine grains is evident from the electron micrographs. Fe3+ has a magnetic moment higher than Mn3+, and hence affects the magnetic property. Thermo-magnetization measurements show the existence of magnetic ordering below 290 K. An increase in magnetization at low temperature is also observed due to ordering of R3+ moments in addition to Fe and Mn spin moments. A linear increase in conductivity and stable dielectric response is observed from impedance study at high temperature.

  18. Microstructural stability of Fe-Cr-Al alloys at 450-550 °C

    NASA Astrophysics Data System (ADS)

    Ejenstam, Jesper; Thuvander, Mattias; Olsson, Pär; Rave, Fernando; Szakalos, Peter

    2015-02-01

    Iron-Chromium-Aluminium (Fe-Cr-Al) alloys have been widely investigated as candidate materials for various nuclear applications. Albeit the excellent corrosion resistance, conventional Fe-Cr-Al alloys suffer from α-α‧ phase separation and embrittlement when subjected to temperatures up to 500 °C, due to their high Cr-content. Low-Cr Fe-Cr-Al alloys are anticipated to be embrittlement resistant and provide adequate oxidation properties, yet long-term aging experiments and simulations are lacking in literature. In this study, Fe-10Cr-(4-8)Al alloys and a Fe-21Cr-5Al were thermally aged in the temperature interval of 450-550 °C for times up to 10,000 h, and the microstructures were evaluated mainly using atom probe tomography. In addition, a Kinetic Monte Carlo (KMC) model of the Fe-Cr-Al system was developed. No phase separation was observed in the Fe-10Cr-(4-8)Al alloys, and the developed KMC model yielded results in good agreement with the experimental data.

  19. Twin nucleation and migration in FeCr single crystals

    SciTech Connect

    Patriarca, L.; Abuzaid, Wael; Sehitoglu, Huseyin; Maier, Hans J.; Chumlyakov, Y.

    2013-01-15

    Tension and compression experiments were conducted on body-centered cubic Fe -47.8 at pct. Cr single crystals. The critical resolved shear stress (CRSS) magnitudes for slip nucleation, twin nucleation and twin migration were established. We show that the nucleation of slip occurs at a CRSS of about 88 MPa, while twinning nucleates at a CRSS of about 191 MPa with an associated load drop. Following twin nucleation, twin migration proceeds at a CRSS that is lower than the initiation stress ( Almost-Equal-To 114-153 MPa). The experimental results of the nucleation stresses indicate that the Schmid law holds to a first approximation for the slip and twin nucleation cases, but to a lesser extent for twin migration particularly when considerable slip strains preceded twinning. The CRSSs were determined experimentally using digital image correlation (DIC) in conjunction with electron back scattering diffraction (EBSD). The DIC measurements enabled pinpointing the precise stress on the stress-strain curves where twins or slip were activated. The crystal orientations were obtained using EBSD and used to determine the activated twin and slip systems through trace analysis. - Highlights: Black-Right-Pointing-Pointer Digital image correlation allows to capture slip/twin initiation for bcc FeCr. Black-Right-Pointing-Pointer Crystal orientations from EBSD allow slip/twin system indexing. Black-Right-Pointing-Pointer Nucleation of slip always precedes twinning. Black-Right-Pointing-Pointer Twin growth is sustained with a lower stress than required for nucleation. Black-Right-Pointing-Pointer Twin-slip interactions provide high hardening at the onset of plasticity.

  20. Effect of vanadium and chromium on the microstructural features of V-Cr-Mn-Ni spheroidal carbide cast irons

    NASA Astrophysics Data System (ADS)

    Efremenko, V. G.; Shimizu, K.; Cheiliakh, A. P.; Kozarevskaya, T. V.; Kusumoto, K.; Yamamoto, K.

    2014-11-01

    The objective of this investigation is to study the influence of vanadium (5.0wt%-10.0wt%) and chromium (0-9.0wt%) on the microstructure and hardness of Cr-V-Mn-Ni white cast irons with spheroidal vanadium carbides. The alloys' microstructural features are presented and discussed with regard to the distribution of phase elements. The structural constituents of the alloys are spheroidal VC, proeutectoid cementite, ledeburite eutectic, rosette-shaped carbide eutectic (based on M7C3), pearlite, martensite, and austenite. Their combinations and area fraction (AF) ratios are reported to be influenced by the alloys' chemical composition. Spheroidized VC particles are found to be sites for the nucleation of carbide eutectics. Cr and V are shown to substitute each other in the VC and M7C3 carbides, respectively. Chromium alloying leads to the formation of a eutectic (γ-Fe + M7C3), preventing the appearance of proeutectoid cementite in the structure. Vanadium and chromium are revealed to increase the total carbide fraction and the amount of austenite in the matrix. Cr is observed to play a key role in controlling the metallic matrix microstructure.

  1. Structural disorder and magnetism in the spin-gapless semiconductor CoFeCrAl

    NASA Astrophysics Data System (ADS)

    Choudhary, Renu; Kharel, Parashu; Valloppilly, Shah R.; Jin, Yunlong; O'Connell, Andrew; Huh, Yung; Gilbert, Simeon; Kashyap, Arti; Sellmyer, D. J.; Skomski, Ralph

    2016-05-01

    Disordered CoFeCrAl and CoFeCrSi0.5Al0.5 alloys have been investigated experimentally and by first-principle calculations. The melt-spun and annealed samples all exhibit Heusler-type superlattice peaks, but the peak intensities indicate a substantial degree of B2-type chemical disorder. Si substitution reduces the degree of this disorder. Our theoretical analysis also considers several types of antisite disorder (Fe-Co, Fe-Cr, Co-Cr) in Y-ordered CoFeCrAl and partial substitution of Si for Al. The substitution transforms the spin-gapless semiconductor CoFeCrAl into a half-metallic ferrimagnet and increases the half-metallic band gap by 0.12 eV. Compared CoFeCrAl, the moment of CoFeCrSi0.5Al0.5 is predicted to increase from 2.01 μB to 2.50 μB per formula unit, in good agreement with experiment.

  2. Grain Boundary Specific Segregation in Nanocrystalline Fe(Cr)

    PubMed Central

    Zhou, Xuyang; Yu, Xiao-xiang; Kaub, Tyler; Martens, Richard L.; Thompson, Gregory B.

    2016-01-01

    A cross-correlative precession electron diffraction – atom probe tomography investigation of Cr segregation in a Fe(Cr) nanocrystalline alloy was undertaken. Solute segregation was found to be dependent on grain boundary type. The results of which were compared to a hybrid Molecular Dynamics and Monte Carlo simulation that predicted the segregation for special character, low angle, and high angle grain boundaries, as well as the angle of inclination of the grain boundary. It was found that the highest segregation concentration was for the high angle grain boundaries and is explained in terms of clustering driven by the onset of phase separation. For special character boundaries, the highest Gibbsain interfacial excess was predicted at the incoherent ∑3 followed by ∑9 and ∑11 boundaries with negligible segregation to the twin and ∑5 boundaries. In addition, the low angle grain boundaries predicted negligible segregation. All of these trends matched well with the experiment. This solute-boundary segregation dependency for the special character grain boundaries is explained in terms of excess volume and the energetic distribution of the solute in the boundary. PMID:27708360

  3. Grain Boundary Specific Segregation in Nanocrystalline Fe(Cr)

    NASA Astrophysics Data System (ADS)

    Zhou, Xuyang; Yu, Xiao-Xiang; Kaub, Tyler; Martens, Richard L.; Thompson, Gregory B.

    2016-10-01

    A cross-correlative precession electron diffraction – atom probe tomography investigation of Cr segregation in a Fe(Cr) nanocrystalline alloy was undertaken. Solute segregation was found to be dependent on grain boundary type. The results of which were compared to a hybrid Molecular Dynamics and Monte Carlo simulation that predicted the segregation for special character, low angle, and high angle grain boundaries, as well as the angle of inclination of the grain boundary. It was found that the highest segregation concentration was for the high angle grain boundaries and is explained in terms of clustering driven by the onset of phase separation. For special character boundaries, the highest Gibbsain interfacial excess was predicted at the incoherent ∑3 followed by ∑9 and ∑11 boundaries with negligible segregation to the twin and ∑5 boundaries. In addition, the low angle grain boundaries predicted negligible segregation. All of these trends matched well with the experiment. This solute-boundary segregation dependency for the special character grain boundaries is explained in terms of excess volume and the energetic distribution of the solute in the boundary.

  4. Cr(VI) removal by FeS-coated alumina, silica, and natural sand

    NASA Astrophysics Data System (ADS)

    Park, M.; Lee, S.; Jeong, H. Y.

    2014-12-01

    Removal of Cr(VI) was investigated using mackinawite (FeS)-coated mineral sorbents under anoxic conditions. The sorbents included alumina (Al), silica (WS), and natural sand (NS). By analysis of both solution and solid phases, all FeS-coated sorbents were found to reduce Cr(VI) into Cr(III). The sorption extent and mechanism of Cr(VI) strongly depended on the pH conditions. Only at pH 4.5, significant amounts of the dissolved Cr remained in the solution. Titration of dissolved Cr(III) and Fe(III) by NaOH solutions indicated that no bulk-phase precipitation occurred at pH 4.5. Also, the removal of Cr(VI) at pH 4.5 was the greatest by FeS-coated NS. Consistent with these, Cr-K edge EXAFS revealed that Cr was removed by FeS-coated NS via surface precipitation, and that it was immobilized by FeS-coated WS and Al by forming surface clusters. Regardless of FeS-coated sorbents, at pH 7.0 and pH 9.5, the initially added Cr(VI) was quantitatively removed from the solution phase. By EXAFS analysis, the Cr sorption by FeS-coated Al was mainly due to the bulk-phase precipitation of Cr(OH)3(s) or [Cr, Fe](OH)3(s). In case of FeS-coated WS and NS, the short Cr-Cr distance (~2.6 Å) at pH 7.0 and pH 9.5 was not simply accounted for by the bulk precipitation as either hydroxide (rCr-Cr ~ 3.0 Å), and it would rather result from the surface precipitation. Such a difference in the coordination structure among FeS-coated sorbents was likely due to in the lower surface area of the former available for the surface precipitation.

  5. FeMn/Fe/Co/Cu(1,1,10) films studied using the magneto-optic Kerr effect and photoemission electron microscopy

    SciTech Connect

    Meng, Y.; Li, J.; Tan, A.; Park, J.; Jin, E.; Son, H.; Doran, A.; Scholl, A.; Arenholz, E.; Zhao, H. W.; Hwang, Chanyong; Qiu, Z. Q.

    2011-07-31

    FeMn/Fe/Co/Cu(1,1,10) films were grown epitaxially and investigated using the magneto-optic Kerr effect and photoemission electron microscopy. We found that FeMn/Fe/Co/Cu(1,1,10) exhibits the same properties as FeMn/Co/Cu(1,1,10) for the ferromagnetic phase of the face centered cubic (fcc) Fe film but a different property for the non-ferromagnetic phase of the fcc Fe film. This result indicates that the characteristic property reported in the literature for FeMn/Co/Cu(001) comes from the FeMn spin structure and is independent of the ferromagnetic layer.

  6. Precipitates of Cr at Σ3 <110> {112} GB in α-Fe

    SciTech Connect

    Dai, Y. Y.; Ao, L.; Sun, Qing- Qiang; Yang, Li; Nie, JL; Peng, SM; Long, XG; Zhou, X. S.; Zu, Xiaotao; Liu, L.; Sun, Xin; Gao, Fei

    2014-01-02

    Precipitates of Cr at Σ3 <110> {112} GB in α-Fe have been studied using molecular dynamics with a two-band embedded atomic model potential. The accumulation and segregation of Cr atoms and the evolution of the GB depend on local Cr concentration and temperature. At the early stage, with the existence of vacancies, the strong attraction of Cr with the GB core provides a pathway for Cr atoms to quickly accumulate within the GB core. With the increase of Cr concentration, the size of Cr dilute precipitates increases dramatically. And the strong segregation of Cr at the GB is observed, when Cr concentration reach 20%. Also, the size of Cr precipitates increases with increasing the temperatures from 300 K to 1000 K. The accumulation and segregation of Cr atoms at the GB lead to significant deformation of the GB structure and the formation of GB steps, causing the displacement and broadening of the GB.

  7. First-principles study on the ferrimagnetic half-metallic Mn2FeAs alloy

    NASA Astrophysics Data System (ADS)

    Qi, Santao; Zhang, Chuan-Hui; Chen, Bao; Shen, Jiang; Chen, Nanxian

    2015-05-01

    Mn-based full-Heusler alloys are kinds of promising candidates for new half-metallic materials. Basing on first principles, the electronic structures and magnetic properties of the Mn2FeAs full-Heusler alloy have been investigated in detail. The Hg2CuTi-type Mn2FeAs compound obeys the Slater-Pauling rule, while the anti-parallel alignment atomic magnetic moments of Mn locating at different sites indicate it a ferrimagnetic alloy. The calculated spin-down bands behave half-metallic character, exhibiting a direct gap of 0.46 eV with a 100% spin polarization at the Fermi level. More studies show the compound would maintain half-metallic nature in a large range of variational lattice constants. We expect that our calculated results may trigger Mn2FeAs applying in the future spintronics field.

  8. Effects of organic additives on electroplated soft magnetic CoFeCr films

    NASA Astrophysics Data System (ADS)

    Lallemand, F.; Comte, D.; Ricq, L.; Renaux, P.; Pagetti, J.; Dieppedale, C.; Gaud, P.

    2004-03-01

    Soft magnetic CoFeCr films produced with high saturation magnetic flux density, Bs=1.7 T, low coercivity, Hc=0.6 Oe, and high film resistivity, ρ=40 μΩ cm, are potentially useful in high density magnetic recording head. The electrodeposition of CoFeCr ternary alloy is investigated in the presence of two sulfur containing organic additives, saccharin (SAC) and o-toluene sulfonamide (oTOL). The results demonstrated that the CoFeCr films produced with SAC or oTOL have the same structural and magnetic properties. However, a corrosion behavior study shows that the CoFeCr deposits prepared with oTOL are very attractive for their stability in corrosive conditions. This additive (oTOL) can be considered as a good candidate for electroplated soft magnetic CoFeCr films.

  9. Charge-Transfer Dynamics in Cyano-Bridged MA-Fe System (MA=Mn, Fe, and Co)

    NASA Astrophysics Data System (ADS)

    Kamioka, Hayato; Moritomo, Yutaka; Kosaka, Wataru; Ohkoshi, Shinichi

    2008-09-01

    Charge-transfer (CT) dynamics has been investigated for Prussian blue-type MA-Fe cyanides (MA=Mn, Fe, and Co) grown in hydrophilic cavities of a Nafion 117 film. In all the compounds, we observed the suppression of the original CT absorption between neighboring transition metals. We found that the spectral profile of the slow component for the Fe compound is similar to that for the Co compound, reflecting the photo created d6 state at the MA site.

  10. Be/W and W/Be bilayers deposited on Si substrates with hydrogenated Fe-Cr and Fe-Cr-Al interlayers for plasma facing components

    NASA Astrophysics Data System (ADS)

    Greculeasa, S. G.; Palade, P.; Schinteie, G.; Lungu, G. A.; Porosnicu, C.; Jepu, I.; Lungu, C. P.; Kuncser, V.

    2016-12-01

    Be/W and W/Be bilayers, of interest in regard to the specific behavior of plasma facing components (PFCs) were deposited on Si substrates by thermionic vacuum arc, with Fe, Fe-Cr and Fe-Cr-Al interlayers. The interlayers, with compositions approaching the one of the reduced activation steels used in supporting PFCs, were subsequently annealed in hydrogen atmosphere. The multilayers were characterized with respect to morphologic, structural, diffusional and atomic intermixing aspects via XRD, XRR, X-ray photoemission spectroscopy and Mössbauer spectroscopy. All as-prepared samples present partially amorphous structures. A main α-Fe phase is observed, as well as (superparamagnetic) secondary Fe oxides, metallic Fe with Si, Cr, W and Be neighbors, Be-rich Fe-Be and Fe-Si phases. High amounts of tungsten and tungsten oxides were also evidenced in the Fe layer. The strong atomic intermixing of W and Be layers was indirectly supported by the unusual densities of W and Be layers and 57Fe Mössbauer spectroscopy results.

  11. On the magnetic structure of noncollinear γ-Fe70Mn30

    NASA Astrophysics Data System (ADS)

    Takahashi, T.; Ukai, T.; Mori, N.

    1988-04-01

    The approximate d bands for a noncollinear γ-FeMn alloy are formulated by using Deegan's method and the formulas of Slater and Koster, and by taking into account the exchange interaction terms to produce the multi-spin-density-wave state. The electronic energies for the noncollinear γ-Fe70Mn30 alloy with the spin directions parallel to [100], [110], and [111] are calculated and the anisotropy energy is determined. It is seen that the state with the spin direction [111] becomes the lowest and the multi-spin-density-wave state is realized in it. For other noncollinear γ-FeMn alloys some discussions are given on the magnetic structure for them. Additionally, the anisotropy energies for noncollinear and collinear γ-FeMn alloys are discussed in detail.

  12. Substituting Fe for two of the four Mn ions in photosystem II-effects on water-oxidation.

    PubMed

    Semin, Boris K; Seibert, Michael

    2016-06-01

    We have investigated the interaction of Fe(II) cations with Ca-depleted PSII membranes (PSII[-Ca,4Mn]) in the dark and found that Fe(II) incubation removes 2 of 4 Mn ions from the tetranuclear Mn cluster of the photosynthetic O2-evolving complex (OEC). The reduction of Mn ions in PSII(-Ca,4Mn) by Fe(II) and the concomitant release of two Mn(II) cations is accompanied by the binding of newly generated Fe(III) in at least one vacated Mn site. Flash-induced chlorophyll (Chl) fluorescence yield measurements of this new 2Mn/nFe cluster (PSII[-Ca,2Mn,nFe]) show that charge recombination in the presence of 3-(3,4-dichlorophenyl)-1,1-dimethylurea (DCMU) occurs between Qa (-) and the remaining Mn/Fe cluster (but not YZ (●)) in the OEC, and extraction of 2 Mn occurs uniformly in all PSII complexes. No O2 evolution is observed, but the heteronuclear metal cluster in PSII(-Ca,2Mn,nFe) samples is still able to supply electrons for reduction of the exogenous electron acceptor, 2,6-dichlorophrenolindophenol, by photooxidizing water and producing H2O2 in the absence of an exogenous donor as seen previously with PSII(-Ca,4Mn). Selective extraction of Mn or Fe cations from the 2Mn/nFe heteronuclear cluster demonstrates that the high-affinity Mn-binding site is occupied by one of the iron cations. It is notable that partial water-oxidation function still occurs when only two Mn cations are present in the PSII OEC.

  13. Microstructure and Dry Sliding Wear Behavior of Fe-Based (Cr, Fe)7C3 Composite Coating Fabricated by PTA Welding Process

    NASA Astrophysics Data System (ADS)

    Yuan, Y. L.; Li, Z. G.

    2013-11-01

    Using Cr3C2 and Fe-CrNiBSi powder blends as raw materials, an α-Fe matrix composite coating reinforced by in situ (Cr, Fe)7C3 rods, with a thickness of about 3.6 mm, was fabricated on the surface of AISI A36 low carbon steel by means of plasma-transferred arc welding. The results of microstructural analysis show that in the coating, a large number of carbides, (Cr, Fe)7C3, in rod shape grow, and radiate around some half-dissolved Cr3C2 particles. The results of dry sliding wear tests at loads 100, 200, and 300 N show that the wear resistances of (Cr, Fe)7C3-reinforced coating, respectively, are about 6.9, 14.9, and 17 times higher than that of nonreinforced pure Fe-CrNiBSi alloy coating; the average value and fluctuation range of friction coefficient (FC) of (Cr, Fe)7C3-reinforced coating are less than those of pure Fe-CrNiBSi alloy coating; the main wear mechanisms of pure Fe-CrNiBSi alloy coating are ploughing, deformation, and adhesive wear, whereas those of (Cr, Fe)7C3-reinforced coating are microcutting, abrasive, and oxidation wear; the cracks on surfaces of (Cr, Fe)7C3 rods increased with the increasing loads; and the matrix α-Fe can prevent them from extending further in the composite coating.

  14. Thermodynamic Modeling and Experimental Study of the Fe-Cr-Zr System

    SciTech Connect

    Yang, Ying; Tan, Lizhen; Bei, Hongbin; Busby, Jeremy T

    2013-01-01

    Wide applications of zircaloys, stainless steels and their interactions in nuclear reactors require the knowledge on phase stability and thermodynamic property of the Fe-Cr-Zr system. This knowledge is also important to develop new Zr-contained Fe-Cr ferritic steels. This work aims at developing thermodynamic models for describing phase stability and thermodynamic property of the Fe-Cr-Zr system using the Calphad approach coupled with experimental study. Thermodynamic descriptions of the Fe-Cr and Cr-Zr systems were either directly adopted or slightly modified from literature. The Fe-Zr system has been remodeled to accommodate recent ab-initio calculation of formation enthalpies of various Fe-Zr compounds. Reliable ternary experimental data and thermodynamic models were mainly available in the Zr-rich region. Therefore, selected ternary alloys located in the vicinity of the eutectic valley of (Fe,Cr,Zr) and (Fe,Cr)2Zr laves phase in the Fe-rich region have been experimentally investigated in this study. Microstructure has been examined by using scanning electron microscope, energy-dispersive Xray spectroscopy and X-ray diffraction. These experimental results, along with the literature data were then used to develop thermodynamic models for phases in the Fe-Cr-Zr system. Calculated phase equilibria and thermodynamic properties of the ternary system yield satisfactory agreements with available experimental data, which gives the confidence to use these models as building blocks for developing a Zr, Fe and Cr contained multicomponent thermodynamic database for broader applications in nuclear reactors.

  15. Effects of helium injection mode on void formation in Fe-Ni-Cr alloys

    NASA Astrophysics Data System (ADS)

    Kimoto, T.; Lee, E. H.; Mansur, L. K.

    1988-09-01

    The effect of the helium injection mode on void formation during ion irradiation of the pure solution-annealing alloys Fe-15Ni-7Cr, Fe-35Ni-7Cr, Fe-45Ni-7Cr, Fe-10Ni-13Cr, Fe-40Ni-13Cr, Fe-45Ni-15Cr was examined. Ion irradiation was carried out with 4 MeV Ni ions at 948 K to doses of 30 to 100 dpa with: (1) no helium injection, (2) simultaneous helium injection and (3) helium preinjection and aging. Swelling variation with helium injection differed among the 7Cr alloys and 13-15Cr alloys. Only the simultaneous helium injection mode produced a bimodal cavity size distribution in the high Ni alloys. The critical radius, as estimated from the cavity size distributions appears to have increased with increasing dose, but no clear variation of the critical radius with composition was observed. Helium preinjection and one-hour aging at 948 K formed helium bubbles along the residual dislocations, while subsequent Ni irradiation caused void formation along the dislocation lines. The calculated helium concentration deduced from observable helium bubbles was low compared with the injected helium concentration in the alloys containing higher Ni and lower Cr.

  16. Tribological Properties of the Fe-Al-Cr Alloyed Layer by Double Glow Plasma Surface Metallurgy

    NASA Astrophysics Data System (ADS)

    Luo, Xixi; Yao, Zhengjun; Zhang, Pingze; Zhou, Keyin; Wang, Zhangzhong

    2016-09-01

    A Fe-Al-Cr alloyed layer was deposited onto the surface of Q235 low-carbon steel via double glow plasma surface metallurgy (DGPSM) to improve the steel's wear resistance. After the DGPSM treatment, the Fe-Al-Cr alloyed layer grown on the Q235 low-carbon steel was homogeneous and compact and had a thickness of 25 µm. The layer was found to be metallurgically adhered to the substrate. The frictional coefficient and specific wear rate of the sample with a Fe-Al-Cr alloyed layer (treated sample) were both lower than those of the bare substrate (untreated sample) at the measured temperatures (25, 250 and 450 °C). The results indicated that the substrate and the alloyed layer suffered oxidative wear and abrasive wear, respectively, and that the treated samples exhibited much better tribological properties than did the substrate. The formation of Fe2AlCr, Fe3Al(Cr), FeAl(Cr), Fe(Cr) sosoloid and Cr23C6 phases in the alloyed layer dramatically enhanced the wear resistance of the treated sample. In addition, the alloyed layer's oxidation film exhibited a self-healing capacity with lubrication action that also contributed to the improvement of the wear resistance at high temperature. In particular, at 450 °C, the specific wear rate of treated sample was 2.524 × 10-4 mm3/N m, which was only 45.2% of the untreated sample.

  17. Tribological Properties of the Fe-Al-Cr Alloyed Layer by Double Glow Plasma Surface Metallurgy

    NASA Astrophysics Data System (ADS)

    Luo, Xixi; Yao, Zhengjun; Zhang, Pingze; Zhou, Keyin; Wang, Zhangzhong

    2016-07-01

    A Fe-Al-Cr alloyed layer was deposited onto the surface of Q235 low-carbon steel via double glow plasma surface metallurgy (DGPSM) to improve the steel's wear resistance. After the DGPSM treatment, the Fe-Al-Cr alloyed layer grown on the Q235 low-carbon steel was homogeneous and compact and had a thickness of 25 µm. The layer was found to be metallurgically adhered to the substrate. The frictional coefficient and specific wear rate of the sample with a Fe-Al-Cr alloyed layer (treated sample) were both lower than those of the bare substrate (untreated sample) at the measured temperatures (25, 250 and 450 °C). The results indicated that the substrate and the alloyed layer suffered oxidative wear and abrasive wear, respectively, and that the treated samples exhibited much better tribological properties than did the substrate. The formation of Fe2AlCr, Fe3Al(Cr), FeAl(Cr), Fe(Cr) sosoloid and Cr23C6 phases in the alloyed layer dramatically enhanced the wear resistance of the treated sample. In addition, the alloyed layer's oxidation film exhibited a self-healing capacity with lubrication action that also contributed to the improvement of the wear resistance at high temperature. In particular, at 450 °C, the specific wear rate of treated sample was 2.524 × 10-4 mm3/N m, which was only 45.2% of the untreated sample.

  18. Synthesis of MFe2O4 (M = Fe, Mn) Nanoparticles with Tunable Sizes

    NASA Astrophysics Data System (ADS)

    Cabrera, Lourdes I.; Somoza, Álvaro; Serna, Carlos J.; Morales, M. Puerto

    2010-10-01

    Monodisperse MFe2O4 ferrite nanoparticles (with M = Fe, and Mn) of narrow size distribution has been achieved in a one step synthesis by thermal decomposition of Mn (II) oleate and Fe (III) oleate, with tunable sizes between 5 and 20 nm. These nanoparticles were functionalized with dimercaptosuccinic acid (DMSA), 11-mercaptoundecanoic acid (MUA) and bis(carboxymethyl)(2-maleimidylethyl)ammonium 4-toluenesulfonate (MATS) for possible biomedical applications.

  19. Exchange anisotropy and micromagnetic properties of PtMn/NiFe bilayers

    NASA Astrophysics Data System (ADS)

    Pokhil, Taras; Linville, Eric; Mao, Sining

    2001-06-01

    Magnetic microstructure, exchange induced uniaxial and unidirectional anisotropy and structural transformation have been studied in PtMn/NiFe bilayer films and small elements as a function of annealing time. The relationship between the fcc-fct ordering phase transformation in PtMn and the development of exchange induced magnetic properties in PtMn/NiFe bilayers is complicated by the fact that the transformation occurs throughout the entire volume of the PtMn film, while the exchange between the layers is predominantly an interface effect. Consequently, the development of the exchange anisotropy should depend primarily on the character of the structural transformation at the interface between PtMn and NiFe. The purpose of this article is to correlate the volume phase transformation in PtMn to the development of exchange anisotropy and micromagnetic behavior in PtMn/NiFe bilayers. The interface structure can be inferred from the anisotropy and micromagnetic measurements, leading to a model that explains the relationship between the volume and interface transformation structures in PtMn, and magnetic properties of the bilayers. The structure and magnetic properties were characterized by x-ray diffraction, vibrating sample magnetometry, and magnetic force microscopy.

  20. Degradable metallic biomaterials: design and development of Fe-Mn alloys for stents.

    PubMed

    Hermawan, Hendra; Dubé, Dominique; Mantovani, Diego

    2010-04-01

    Designing materials having suitable mechanical properties and targeted degradation behavior is the key for the development of biodegradable materials for medical applications, including stents. A series of Fe-Mn alloys was developed with the objective to obtain mechanical properties similar to those of stainless steel 316L and degradation behavior more suited than pure iron. Four alloys with Mn content ranging between 20 and 35 wt % were compared in this study. Their microstructure, mechanical properties, magnetic properties as well as degradation behavior were carefully investigated. Results show that their microstructure is mainly composed of gamma phase with the appearance of epsilon phase in alloys having a lower Mn content. The yield strength and elongation of alloys was comprised between 234 MPa and 32% for Fe-35%Mn alloy to 421 MPa and 7.5% for the Fe-20%Mn alloy. All alloys show similar magnetic susceptibility ( approximately 1.8 x 10(-7) m(3)/kg) in the quenched condition. This magnetic susceptibility remains constant after plastic deformation for all the tested alloys except for the Fe-20%Mn alloy. The corrosion rate was higher than pure iron. Among the alloys studied in this work, the Fe-35%Mn alloy shows mechanical properties and degradation behavior closely approaching those required for biodegradable stents application.

  1. Degradable metallic biomaterials: design and development of Fe-Mn alloys for stents.

    PubMed

    Hermawan, Hendra; Dubé, Dominique; Mantovani, Diego

    2010-04-01

    Designing materials having suitable mechanical properties and targeted degradation behavior is the key for the development of biodegradable materials for medical applications, including stents. A series of Fe-Mn alloys was developed with the objective to obtain mechanical properties similar to those of stainless steel 316L and degradation behavior more suited than pure iron. Four alloys with Mn content ranging between 20 and 35 wt % were compared in this study. Their microstructure, mechanical properties, magnetic properties as well as degradation behavior were carefully investigated. Results show that their microstructure is mainly composed of gamma phase with the appearance of epsilon phase in alloys having a lower Mn content. The yield strength and elongation of alloys was comprised between 234 MPa and 32% for Fe-35%Mn alloy to 421 MPa and 7.5% for the Fe-20%Mn alloy. All alloys show similar magnetic susceptibility ( approximately 1.8 x 10(-7) m(3)/kg) in the quenched condition. This magnetic susceptibility remains constant after plastic deformation for all the tested alloys except for the Fe-20%Mn alloy. The corrosion rate was higher than pure iron. Among the alloys studied in this work, the Fe-35%Mn alloy shows mechanical properties and degradation behavior closely approaching those required for biodegradable stents application. PMID:19437432

  2. Atomic structural and electrochemical impact of Fe substitution on nano porous LiMnPO4

    NASA Astrophysics Data System (ADS)

    Seo, Inseok; Senthilkumar, B.; Kim, Kwang-Ho; Kim, Jae-Kwang; Kim, Youngsik; Ahn, Jou-Hyeon

    2016-07-01

    The atomic structural and electrochemical properties of Fe substituted nano porous LiMn1-xFexPO4 (x = 0-0.8) composites are investigated and compared. X-ray scattering method is used for atomic structural investigation. Rietveld refinement shows that all Fe substituted composites have the same olivine structure (Pnma) with lithium occupying octahedral 4a sites, Fe2+ replacing Mn2+ at the octahedral 4c sites. The a, b, c parameters and cell volume decrease with the addition of Fe2+. When the nano porous LiMn1-xFexPO4 composites are evaluated as cathode materials in lithium cells at room temperature, x = 0.6, and 0.8 resulted in the best overall electrochemical performance, exhibiting stable cycling and high discharge capacities of 149 and 154 mA h g-1, respectively. The composites with above x = 0.4 show a fast lithium ions transfer with high electronic conductivity because Fe transition metal substitution reduce the partly occupation of Mn in the M1 (LiO6) sites and thereby Mn block the lithium ion diffusion pathway. We here firstly find the antisite defect in the high Mn content in porous LiMn1-xFexPO4 composites.

  3. On the radiation-induced segregation: Contribution of interstitial mechanism in Fe-Cr alloys

    NASA Astrophysics Data System (ADS)

    Pechenkin, V. A.; Molodtsov, V. L.; Ryabov, V. A.; Terentyev, D.

    2013-02-01

    In this work, we perform molecular dynamics simulations to study the diffusion characteristics of a self-interstitial atom (SIA) in BCC Fe-Cr alloys and corresponding mass transport of Fe and Cr atoms via SIA migration mechanism. The calculations have been performed in the temperature range 600-1000 K in the alloys with Cr content 5-25 at.%, which is relevant for ferritic/martensitic steels. The results of atomistic simulations have been applied to evaluate the contribution of SIA diffusion mechanism to radiation-induced segregation (RIS) phenomenon. An original treatment is proposed in this work to account for the contribution from both vacancy and SIA mechanisms to RIS at sinks for point defects in multi-component system. By combining available experimental data on diffusion of Fe and Cr via vacancy mechanism with the results of MD simulations for SIAs, we demonstrate that enrichment of sinks by Cr atoms is possible in the Fe-Cr alloys containing less than 13% Cr. This result is discussed in the light of available experimental data on the RIS in Fe-Cr alloys and ferritic/martensitic steels. It is predicted that the degree of the Cr enrichment goes up with decreasing Cr content in the alloy and irradiation temperature.

  4. Influence of Mn substitution on crystal structure and magnetocrystalline anisotropy of nanocrystalline Co1- x Mn x Fe2-2 x Mn2 x O4

    NASA Astrophysics Data System (ADS)

    Kumar, Lawrence; Kumar, Pawan; Kar, Manoranjan

    2013-02-01

    Nanocrystalline Mn substituted cobalt ferrite Co1- x Mn x Fe2-2 x Mn2 x O4 ( x = 0.0-0.4) has been synthesized by the standard citrate-gel method. The structural and magnetic characteristics of all samples have been studied using powder X-ray diffraction, Fourier transform infrared spectroscopy (FT-IR), field emission scanning electron microscope (FE-SEM) and VSM techniques. Distributions of cations between the two interstitial sites (tetrahedral and octahedral site) have been estimated qualitatively by analyzing the powder X-ray diffraction patterns by employing the Rietveld refinement technique. All samples are found to be mixed spinel with cubic structure ( Fdmathop 3limits^{ - } m space group). The FT-IR study shows the presence of absorption bands in the range of 390-750 cm-1, which confirm the spinel structure of the sample. The stoichiometry of Co, Fe, Mn and O ions in the sample has been obtained by using energy-dispersive spectrum with help of an FE-SEM. The magnetizations in saturation have been analyzed by employing the "law of approach" technique. The saturation magnetization, coercivity and magnetocrystalline anisotropy constant depend upon Mn ion concentration and crystallite size.

  5. Influence of the chemical composition of rapidly quenched amorphous alloys (Ni, Fe, Cr)-B-Si on its crystallization process

    NASA Astrophysics Data System (ADS)

    Elmanov, G.; Dzhumaev, P.; Ivanitskaya, E.; Skrytnyi, V.; Ruslanov, A.

    2016-04-01

    This paper presents results of research of the structure and phase transformations during the multistage crystallization of the metallic glasses with the compositions Ni71,5Cr6,8Fe2,7B11,9Si7,1 and Ni63,4Cr7,4Fe4,3Mn0,8B15,6Si8,5 labeled as AWS BNi-2 according to American Welding Society. Differential scanning calorimetry (DSC), X-ray diffraction analysis (XRD), scanning electron microscopy (SEM) and energy-dispersive X-ray microanalysis (EDX) were used as experimental research methods. The influence of the alloys chemical composition (boron, manganese and iron) on the temperatures and the exothermic heat effects of phase transformations, as well as on the phase composition of alloys at three stages of crystallization was analyzed. We present a thermodynamic explanation of the observed heat effects. It has been shown that manganese has the main influence on the phase transformations temperatures and heat effects in these two alloys. It is also assumed that at the final crystallization stage simultaneously with the formation of phases Ni3B and β1-Ni3Si should occur the nucleation of borides of CrB type with high Cr and low Si content.

  6. Catalytic ozonation of petroleum refinery wastewater utilizing Mn-Fe-Cu/Al2O 3 catalyst.

    PubMed

    Chen, Chunmao; Yoza, Brandon A; Wang, Yandan; Wang, Ping; Li, Qing X; Guo, Shaohui; Yan, Guangxu

    2015-04-01

    There is of great interest to develop an economic and high-efficient catalytic ozonation system (COS) for the treatment of biologically refractory wastewaters. Applications of COS require options of commercially feasible catalysts. Experiments in the present study were designed to prepare and investigate a novel manganese-iron-copper oxide-supported alumina-assisted COS (Mn-Fe-Cu/Al2O3-COS) for the pretreatment of petroleum refinery wastewater. The highly dispersed composite metal oxides on the catalyst surface greatly promoted the performance of catalytic ozonation. Hydroxyl radical mediated oxidation is a dominant reaction in Mn-Fe-Cu/Al2O3-COS. Mn-Fe-Cu/Al2O3-COS enhanced COD removal by 32.7% compared with a single ozonation system and by 8-16% compared with Mn-Fe/Al2O3-COS, Mn-Cu/Al2O3-COS, and Fe-Cu/Al2O3-COS. The O/C and H/C ratios of oxygen-containing polar compounds significantly increased after catalytic ozonation, and the biodegradability of petroleum refinery wastewater was significantly improved. This study illustrates potential applications of Mn-Fe-Cu/Al2O3-COS for pretreatment of biologically refractory wastewaters.

  7. Fe and Mn removal from mining drainage using goaf filling materials obtained from coal mining process.

    PubMed

    Zhang, Liping; Chen, Aolei; Qu, Hongbin; Xu, Shouqiang; Zhang, Xue; He, Xuwen

    2015-01-01

    Coal gangue, sandy soil and clay (mass ratio 45:4:1) as goaf filling materials acquired from coal mining processes were applied to remove Fe and Mn effectively from mining drainage. The results of an adsorption kinetic study showed that the Fe adsorption equation was y=21.454y+8.4712, R2=0.9924 and the Mn adsorption equation was y=7.5409x+0.905, R2=0.9957. Meanwhile, the goaf filling materials had low desorption capacity (Fe 6.765 μg/g, Mn 1.52 μg/g) and desorption ratio (Fe 8.98%, Mn 11.04%). Experiments demonstrated that Fe and Mn from mining drainage could be removed stably at a flow rate of 1.2 L/min, Fe inlet concentration of less than 40 mg/L, Mn inlet concentration of less than 2 mg/L and neutral or alkaline conditions. During a procedure of continuous experiments, the effluent quality could meet the requirement of the 'Code for Engineering Design of Sewage Regeneration-GB503352-2002'. A real-application project using goaf filling materials to treat mining drainage in Shendong coal mine showed that the average cost per ton of mining drainage was about 0.55 RMB, which could bring about considerable economic benefit for coal mining enterprises. PMID:26606087

  8. Removal of tetracycline from water by Fe-Mn binary oxide.

    PubMed

    Liu, Huijuan; Yang, Yang; Kang, Jin; Fan, Maohong; Qu, Jiuhui

    2012-01-01

    Significant concerns have been raised over the presence of antibiotics including tetracyclines in aquatic environments. A series of Fe-Mn binary oxide with different Fe:Mn molar ratios was synthesized by a simultaneous oxidation and coprecipitation process for TC removal. Results showed that Fe-Mn binary oxide had higher removal efficiency than that of hydrous iron oxide and hydrous manganese oxide, and that the oxide with a Fe:Mn molar ratio of 5:1 was the best in removal than other molar ratios. The tetracycline removal was highly pH dependent. The removal of tetracycline decreased with the increase of initial concentration, but the absolute removal quantity was more at high concentration. The presence of cations and anions such as Ca2+, Mg2+, CO3(2-) and SO4(2-) had no significant effect on the tetracycline removal in our experimental conditions, while SiO3(2-) and PO4(3-) had hindered the adsorption of tetracycline. The mechanism investigation found that tetracycline removal was mainly achieved by the replacement of surface hydroxyl groups by the tetracycline species and formation of surface complexes at the water/oxide interface. This primary study suggests that Fe-Mn binary oxide with a proper Fe:Mn molar ratio will be a very promising material for the removal of tetracycline from aqueous solutions. PMID:22655383

  9. Catalytic ozonation of petroleum refinery wastewater utilizing Mn-Fe-Cu/Al2O 3 catalyst.

    PubMed

    Chen, Chunmao; Yoza, Brandon A; Wang, Yandan; Wang, Ping; Li, Qing X; Guo, Shaohui; Yan, Guangxu

    2015-04-01

    There is of great interest to develop an economic and high-efficient catalytic ozonation system (COS) for the treatment of biologically refractory wastewaters. Applications of COS require options of commercially feasible catalysts. Experiments in the present study were designed to prepare and investigate a novel manganese-iron-copper oxide-supported alumina-assisted COS (Mn-Fe-Cu/Al2O3-COS) for the pretreatment of petroleum refinery wastewater. The highly dispersed composite metal oxides on the catalyst surface greatly promoted the performance of catalytic ozonation. Hydroxyl radical mediated oxidation is a dominant reaction in Mn-Fe-Cu/Al2O3-COS. Mn-Fe-Cu/Al2O3-COS enhanced COD removal by 32.7% compared with a single ozonation system and by 8-16% compared with Mn-Fe/Al2O3-COS, Mn-Cu/Al2O3-COS, and Fe-Cu/Al2O3-COS. The O/C and H/C ratios of oxygen-containing polar compounds significantly increased after catalytic ozonation, and the biodegradability of petroleum refinery wastewater was significantly improved. This study illustrates potential applications of Mn-Fe-Cu/Al2O3-COS for pretreatment of biologically refractory wastewaters. PMID:25649390

  10. Effects of salinity and humic acid on the sorption of Hg on Fe and Mn hydroxides.

    PubMed

    Liang, Peng; Li, Yi-Chun; Zhang, Chan; Wu, Sheng-Chun; Cui, Hao-Jie; Yu, Shen; Wong, Ming H

    2013-01-15

    The objective of this study was to investigate the influence of humic acid (HA) and salinity on adsorption of Hg on the amorphous and crystalline of iron and manganese hydroxides. The results show that the adsorption of Hg(2+) on Fe and Mn hydroxides was inhibited in marine system due to the formation of stable, nonsorbing aqueous HgCl(2) complexes in solution. Moreover, Cl(-) inhibited the Hg(2+) adsorption more severely on amorphous than crystalline hydroxides. The addition of HA inhibited Hg(2+) adsorption on Fe and Mn hydroxides in freshwater system might be attributed to the competition between Hg(2+) and HA on adsorption to Fe and Mn hydroxides. In contrast, the addition of HA promoted Hg(2+) adsorption on Fe and Mn hydroxides in the marine system, which might be due to the addition of humic acid resulted in the reaction between Cl(-) and HA, and therefore the reducing of Cl(-) promoted more Hg(2+) on Fe and Mn hydroxides. In addition, the influence of HA on Hg(2+) adsorption on Fe and Mn hydroxides are more visible for crystalline than amorphous hydroxides.

  11. Low-energy Coulomb excitation of 62Fe and 62Mn following in-beam decay of 62Mn

    NASA Astrophysics Data System (ADS)

    Gaffney, L. P.; Van de Walle, J.; Bastin, B.; Bildstein, V.; Blazhev, A.; Bree, N.; Cederkäll, J.; Darby, I.; De Witte, H.; DiJulio, D.; Diriken, J.; Fedosseev, V. N.; Fransen, Ch.; Gernhäuser, R.; Gustafsson, A.; Hess, H.; Huyse, M.; Kesteloot, N.; Kröll, Th.; Lutter, R.; Marsh, B. A.; Reiter, P.; Seidlitz, M.; Van Duppen, P.; Voulot, D.; Warr, N.; Wenander, F.; Wimmer, K.; Wrzosek-Lipska, K.

    2015-10-01

    Sub-barrier Coulomb excitation was performed on a mixed beam of 62Mn and 62Fe, following in-trap β - decay of 62Mn at REX-ISOLDE, CERN. The trapping and charge breeding times were varied in order to alter the composition of the beam, which was measured by means of an ionisation chamber at the zero-angle position of the Miniball array. A new transition was observed at 418 keV, which has been tentatively associated to a (2+,3+)→ 1 g.s. + transition. This fixes the relative positions of the β-decaying 4+ and 1+ states in 62Mn for the first time. Population of the 2 1 + state was observed in 62Fe and the cross-section determined by normalisation to the 109Ag target excitation, confirming the B( E2) value measured in recoil-distance lifetime experiments.

  12. Structural and magnetic properties of MnPd/Fe grown on MgO(100) substrate: Ab initio studies

    NASA Astrophysics Data System (ADS)

    Malonda-Boungou, B. R.; Magnoungou, J. H. J.; M'Passi-Mabiala, B.; Demangeat, C.

    2016-07-01

    Structural and magnetic properties of ultrathin films MnPd/Fe grown on MgO(001) are investigated using a self-consistent pseudopotential plane waves method based on density functional theory in the Perdew-Burke-Ernzerhof generalized gradient approximation. The results obtained reveal the presence of an antiferromagnetic coupling between successive Mn [100] rows, combined with a ripple where Mn outward atoms exhibit a positive magnetic moment, in the case of Mn overlayer on Fe/MgO(001). In the case of MnPd monolayer ordered alloy, the c(2 × 2) structure formation is more favorable than the p(1 × 2) one, exhibiting a ferromagnetic coupling between Mn neighbor atoms with a positive induced ferromagnetic moment on Pd atoms. Pd atoms are pushed outward. For 1-ML MnxPd1 - x on Fe/MgO, the Mn absolute mean magnetization per atom increases as x coverage increases, whereas the Pd mean induced magnetic moment decreases. For systems alternating Mn and Pd monolayers on Fe/MgO(001), a complex magnetic structure is shown on Mn monolayers: changing from Mn neighboring antiferromagnetic coupling to Mn [010] rows antiferromagnetic behavior. The correlation is made between the electronic structure and the magnetic properties, by comparing filled with partially filled components (Pd, Mn and Fe) d-bands. The magnetization easy-axis changes between the in-plane and the out-of-plane orientations from Fe/MgO to MnPd/Fe/MgO systems.

  13. Magnetic properties of MnBi based alloys: First-principles calculations for MnBi-Co and MnBi-Co-Fe cases

    SciTech Connect

    Hong, YK; Park, J; Mryasov, ON; Kim, SG; Kim, S; Lee, J; Abo, GS; Choi, CJ; Lee, J

    2013-05-01

    First-principles calculations of fundamental magnetic properties were performed for ordered MnBi, MnBi-Co, and MnBi-Co-Fe alloys to evaluate maximum energy product (BH)(max). Full potential linear-augmented plane wave (FLAPW) and linear-muffin-tin-orbital (LMTO) calculations using density functional theory (DFT) within the local spin density approximation (LSDA) were used and found to give a reasonable description of saturation magnetization (M-s), effective anisotropy constant (K-eff), and Curie temperature (T-c) for NiAs-structured MnBi crystal. We found that upon addition of Co, the M-s and K-eff increased, while T-c reduced. The magnetic anisotropy changed from weak anisotropy easy plane for MnBi to the strong easy axis anisotropy for MnBi-Co and MnBi-Co-Fe. (C) 2013 Author(s). All article content, except where otherwise noted, is licensed under a Creative Commons Attribution 3.0 Unported License.

  14. Development of ODS FeCrAl alloys for accident-tolerant fuel cladding

    SciTech Connect

    Dryepondt, Sebastien N.; Hoelzer, David T.; Pint, Bruce A.; Unocic, Kinga A.

    2015-09-18

    FeCrAl alloys are prime candidates for accident-tolerant fuel cladding due to their excellent oxidation resistance up to 1400 C and good mechanical properties at intermediate temperature. Former commercial oxide dispersion strengthened (ODS) FeCrAl alloys such as PM2000 exhibit significantly better tensile strength than wrought FeCrAl alloys, which would alloy for the fabrication of a very thin (~250 m) ODS FeCrAl cladding and limit the neutronic penalty from the replacement of Zr-based alloys by Fe-based alloys. Several Fe-12-Cr-5Al ODS alloys where therefore fabricated by ball milling FeCrAl powders with Y2O3 and additional oxides such as TiO2 or ZrO2. The new Fe-12Cr-5Al ODS alloys showed excellent tensile strength up to 800 C but limited ductility. Good oxidation resistance in steam at 1200 and 1400 C was observed except for one ODS FeCrAl alloy containing Ti. Rolling trials were conducted at 300, 600 C and 800 C to simulate the fabrication of thin tube cladding and a plate thickness of ~0.6mm was reached before the formation of multiple edge cracks. Hardness measurements at different stages of the rolling process, before and after annealing for 1h at 1000 C, showed that a thinner plate thickness could likely be achieved by using a multi-step approach combining warm rolling and high temperature annealing. Finally, new Fe-10-12Cr-5.5-6Al-Z gas atomized powders have been purchased to fabricate the second generation of low-Cr ODS FeCrAl alloys. The main goals are to assess the effect of O, C, N and Zr contents on the ODS FeCrAl microstructure and mechanical properties, and to optimize the fabrication process to improve the ductility of the 2nd gen ODS FeCrAl while maintaining good mechanical strength and oxidation resistance.

  15. Segregation, precipitation, and α -α' phase separation in Fe-Cr alloys

    NASA Astrophysics Data System (ADS)

    Kuronen, A.; Granroth, S.; Heinonen, M. H.; Perälä, R. E.; Kilpi, T.; Laukkanen, P.; Lâng, J.; Dahl, J.; Punkkinen, M. P. J.; Kokko, K.; Ropo, M.; Johansson, B.; Vitos, L.

    2015-12-01

    Iron-chromium alloys, the base components of various stainless steel grades, have numerous technologically and scientifically interesting properties. However, these features are not yet sufficiently understood to allow their full exploitation in technological applications. In this work, we investigate segregation, precipitation, and phase separation in Fe-Cr systems analyzing the physical mechanisms behind the observed phenomena. To get a comprehensive picture of Fe-Cr alloys as a function of composition, temperature, and time the present investigation combines Monte Carlo simulations using semiempirical interatomic potential, first-principles total energy calculations, and experimental spectroscopy. In order to obtain a general picture of the relation of the atomic interactions and properties of Fe-Cr alloys in bulk, surface, and interface regions several complementary methods have to be used. Using the exact muffin-tin orbitals method with the coherent potential approximation (CPA-EMTO) the effective chemical potential as a function of Cr content (0-15 at. % Cr) is calculated for a surface, second atomic layer, and bulk. At ˜10 at. % Cr in the alloy the reversal of the driving force of a Cr atom to occupy either bulk or surface sites is obtained. The Cr-containing surfaces are expected when the Cr content exceeds ˜10 at. %. The second atomic layer forms about a 0.3 eV barrier for the migration of Cr atoms between the bulk and surface atomic layer. To get information on Fe-Cr in larger scales we use semiempirical methods. However, for Cr concentration regions less than 10 at. %, the ab initio (CPA-EMTO) result of the important role of the second atomic layer to the surface is not reproducible from the large-scale Monte Carlo molecular dynamics (MCMD) simulation. On the other hand, for the nominal concentration of Cr larger than 10 at. % the MCMD simulations show the precipitation of Cr into isolated pockets in bulk Fe-Cr and the existence of the upper limit of

  16. Thermal stability of spin valves based on a synthetic antiferromagnet and Fe50Mn50 alloy

    NASA Astrophysics Data System (ADS)

    Milyaev, M. A.; Naumova, L. I.; Proglyado, V. V.; Chernyshova, T. A.; Blagodatkov, D. V.; Kamenskii, I. Yu.; Ustinov, V. V.

    2015-11-01

    Magnetron sputtering was used to prepare spin valves with the Ta/Ni80Fe20/Co90Fe10/Cu/Co90Fe10/Ru/Co90Fe10/Fe50Mn50/Ta composition. Changes in the functional characteristics of the spin valves were studied in a temperature range of-180 to +160°C. The maximum temperature at which the functional characteristics of spin valve remain unchanged was shown to depend on the relationship of thicknesses of Co90Fe10 layers separated by the Ru interlayer.

  17. Anomalous power dependence in the zero-field resonance for the molecular nanomagnet Cr7Mn

    NASA Astrophysics Data System (ADS)

    Collett, C. A.; Timco, G. A.; Winpenny, R. E. P.; Friedman, J. R.

    We report electron-spin resonance studies of the paramagnetic ring [(CH3)2NH2][Cr7MnF8((CH3)3CCOO)16] (''Cr7Mn''), a spin S=1 molecular nanomagnet with a large zero-field ground-state tunnel splitting of ~4 GHz. We perform parallel-mode electron-spin-resonance (ESR) spectroscopy with loop-gap resonators (LGRs) with resonance frequencies of 4-6 GHz. A crystal of Cr7Mn is placed on the loop of the LGR with the sample's easy axis parallel to the field. We observe an ESR peak at zero dc field. With increasing radiation power, a pronounced dip develops in the center of the resonance peak, indicating a decoupling of the sample from the resonator with increased power. The onset of this decoupling depends on both the temperature and the applied power, with greater power required to observe the dip at higher temperatures. By pulsing the radiation, we can rule out that the dip is related to sample heating or saturation of the resonance. Power, temperature, and frequency dependence of the decoupling will be presented, and possible explanations will be discussed.

  18. Compositional Zoning and Mn-Cr Systematics in Carbonates from the Y791198 CM2 Carbonaceous Chondrite

    NASA Technical Reports Server (NTRS)

    Brearley, Adrian J.; Hutcheon, Ian D.; Browning, Lauren

    2001-01-01

    Cathodoluminescence and microprobe analyses show that carbonates in Y791198 exhibit complex zoning. Cr-Mn dating suggests formation of carbonates 10 Ma after CAI formation Additional information is contained in the original extended abstract..

  19. Electronic and magnetic properties of Cr-Mn-Ni-Al compound with LiMgPdSb-type structure

    NASA Astrophysics Data System (ADS)

    Wang, L. Y.; Wang, X. T.; Guo, R. K.; Lin, T. T.; Liu, G. D.

    2016-10-01

    We investigate the electronic and magnetic properties of Cr-Mn-Ni-Al compound with a LiMgPdSn-type structure in three different atomic arrangement configurations (AAC) by using the first-principles calculations. It was found that Cr-Mn-Ni-Al compound with type I AAC exhibits a spin-gapless semiconductive characteristic. The type II AAC is the most stable one and exhibits an especial band structure where the Fermi level slightly crosses the top of the valence bands in spin-up channel and the bottom of conductive bands in spin-down channel, which leads to the electronic transport with the spin-resolved carrier type. The Cr-Mn-Ni-Al compound shows an ordinary metallic behavior in type III AAC. The three nonequivalent atomic arrangement configurations of Cr-Mn-Ni-Al are all in ferromagnetic ground state under their equilibrium lattice parameters.

  20. Influence of Cr on the nanoclusters formation and superferromagnetic behavior of Fe-Cr-Nb-B glassy alloys

    NASA Astrophysics Data System (ADS)

    Chiriac, H.; Whitmore, L.; Grigoras, M.; Ababei, G.; Stoian, G.; Lupu, N.

    2015-05-01

    High resolution imaging and electron diffraction confirm that in the as-quenched state the structure of Fe79.7-xCrxNb0.3B20 (x = 11-13 at. %) melt-spun ribbons is completely amorphous, independent of the Cr content. Energy-dispersive X-ray spectroscopy mapping emphasizes clearly the presence of Fe and Cr clusters varying from approximately 1 to 2-3 nm in size with the increase of Cr content from 11 to 13 at. %. The Fe and Cr atoms segregate the atomic scale to form nanometer sized clusters, influencing strongly the macroscopic magnetic behavior. The Curie temperature of the system, TCsystem, confirmed by the magnetic susceptibility versus temperature measurements, gives the strength of the magnetic interactions between clusters. The inter-cluster interactions are much stronger for lower contents of Cr, the microstructure is less uniform, and TCsystem increases from 290 K for 13 at. % Cr to 330 K for 11.5 at. % Cr. The whole system transforms to a ferromagnetic state through interactions between the clusters. Zero-field cooling and field cooling curves confirm the cluster behavior with a blocking temperature, Tb, of about 250 K. Above Tb, the ribbons behave as a superferromagnetic system, whilst below the blocking temperature a classical ferromagnetic behavior is observed.

  1. Characterisation of Cr, Si and P distribution at dislocations and grain-boundaries in neutron irradiated Fe-Cr model alloys of low purity

    NASA Astrophysics Data System (ADS)

    Kuksenko, V.; Pareige, C.; Genevois, C.; Pareige, P.

    2013-03-01

    Segregations at some dislocations and grain boundaries in Fe-5%Cr, Fe-9%Cr and Fe-12%Cr model alloys of low purity after neutron irradiation at 300 °C up to 0.6 dpa have been analyzed with atom probe tomography. All dislocation lines and low- and high-angle grain boundaries (GBs) which have been observed were enriched with Cr, Si and P. The segregations reveal the different dislocation structures associated to different type of analysed GBs. Cr and Si atoms were found to be nonhomogenously distributed around the dislocation cores because of the non isotropic stress field induced by edge dislocation lines. Concerning GBs, precipitate free zones (PFZs) are exhibited around the planar defects which were analysed in Fe-9%Cr and Fe-12%Cr model alloys. These PFZ are size dependant with the nominal level of Cr.

  2. Tensile testing of Fe and FeCr nanowires using molecular dynamics simulations

    SciTech Connect

    Byggmästar, J. Granberg, F.; Kuronen, A.; Nordlund, K.; Henriksson, K. O. E.

    2015-01-07

    Using molecular dynamics, we have studied the behaviour of cylindrical [001]-oriented Fe and FeCr nanowires under uniaxial tensile strain with both an embedded atom method (EAM) and a Tersoff-like bond order potential. The mechanical properties were analysed and the deformation mechanism was studied and compared between the potentials. The effects of chromium content and size of the wire were studied. Both potentials show elongation by deformation twinning in the 〈111〉/(211) system resulting in a significantly stiffer and stronger [110]-axial nanowire. The pure iron nanowires are elastically softer than bulk iron and an addition of chromium has both a softening and weakening effect. The bond order potential shows a strong dependence on chromium concentration, while the dependence is considerably weaker for the EAM potential.

  3. Synthesis and high-efficiency methylene blue adsorption of magnetic PAA/MnFe2O4 nanocomposites

    NASA Astrophysics Data System (ADS)

    Wang, Wei; Ding, Zui; Cai, Minhan; Jian, Haitao; Zeng, Zhiqiao; Li, Feng; Liu, J. Ping

    2015-08-01

    MnFe2O4 nanoparticles and polyacrylic acid PAA/MnFe2O4 nanocomposites were synthesized by a hydrothermal method and ultrasonic mixing process. The obtained materials were characterized by XRD, FTIR, SEM, TEM, and VSM. XRD patterns indicate that the synthesized MnFe2O4 nanoparticles have a single cubic spinel phase. SEM images confirm the existence of three types of basic morphology of MnFe2O4 nanoparticles: octahedral, flower-like, and plate-like particles. High saturation magnetization Ms (up to 74.6 emu/g) of the as-synthesized MnFe2O4 nanoparticles was obtained. Experiments demonstrate that the variation of the hydrothermal reaction time does not remarkably affect the magnetic properties of MnFe2O4 nanoparticles. In PAA/MnFe2O4 nanocomposites, the coating of PAA leads to a slight decrease in magnetization of MnFe2O4 nanoparticles. Additionally, PAA coating greatly enhances the adsorption properties of MnFe2O4 nanoparticles for Methylene Blue (MB) dye. Especially, the removal efficiency reaches 96.3%. This research indicates that the as-synthesized PAA/MnFe2O4 nanocomposites exhibit excellent magnetic properties and can be taken as a promising adsorbent for removal of MB dye in industrial scale.

  4. 53Mn-53Cr dating of aqueously formed carbonates in the CM2 lithology of the Sutter's Mill carbonaceous chondrite

    NASA Astrophysics Data System (ADS)

    Jilly, Christine E.; Huss, Gary R.; Krot, Alexander N.; Nagashima, Kazuhide; Yin, Qing-Zhu; Sugiura, Naoji

    2014-11-01

    Radiometric dating of secondary minerals can be used to constrain the timing of aqueous alteration on meteoritic parent bodies. Dolomite is a well-documented secondary mineral in CM chondrites, and is thought to have formed by precipitation from an aqueous fluid on the CM parent body within several million years of accretion. The petrographic context of crosscutting dolomite veins indicates that aqueous alteration occurred in situ, rather than in the nebular setting. Here, we present 53Mn-53Cr systematics for dolomite grains in Sutter's Mill section SM51-1. The Mn-Cr isotope data show well-resolved excesses of 53Cr correlated with 55Mn/52Cr ratio, which we interpret as evidence for the in situ decay of radioactive 53Mn. After correcting for the relative sensitivities of Mn and Cr using a synthetic Mn- and Cr-bearing calcite standard, the data yield an isochron with slope corresponding to an initial 53Mn/55Mn ratio of 3.42 ± 0.86 × 10-6. The reported error includes systematic uncertainty from the relative sensitivity factor. When calculated relative to the U-corrected Pb-Pb absolute age of the D'Orbigny angrite, Sutter's Mill dolomites give a formation age between 4564.8 and 4562.2 Ma (2.4-5.0 Myr after the birth of the solar system). This age is contemporaneous with previously reported ages for secondary carbonates in CM and CI chondrites. Consistent carbonate precipitation ages between the carbonaceous chondrite groups suggest that aqueous alteration was a common process during the early stages of parent body formation, probably occurring via heating from internal 26Al decay. The high-precision isochron for Sutter's Mill dolomite indicates that late-stage processing did not reach temperatures that were high enough to further disturb the Mn-Cr isochron.

  5. The interlayer exchange interaction in multilayer magnetic systems Fe/Cr/Fe (Review Article)

    NASA Astrophysics Data System (ADS)

    Kreines, N. M.; Kholin, D. I.; Demokritov, S. O.

    2012-09-01

    Upsurge of interest in the study of magnetic multilayer structures began in the mid-80s of the twentieth century and was caused by significant progress in the technology of ultrathin metallic films. For a few years, phenomena extremely interesting from both fundamental and applied point of view have been found in these structures: the antiparallel arrangement of the ferromagnetic layers, giant magnetoresistance, alternating oscillations of the interlayer exchange, noncollinear interlayer ordering of magnetic moments. All this and the closeness of technologies, used for the sample preparation to those traditionally applied in microelectronics, promised great potentials for developing compact magnetic field sensors, non-volatile memory for electronic devices, etc. To date, some of these features are already implemented in the mass commercial products (e.g., read heads of hard drives), and others still wait in the wings. The Nobel Prize, awarded in 2007 to A. Fert and P. Grünberg with the words "For the discovery of the giant magnetoresistance effect" can be considered as recognition of the importance of the discoveries made in this area. A special place in these works was given to the Fe/Cr/Fe system. It is there for the first time almost all of the most interesting phenomena were observed that caused a boom in the physics of magnetic films. However, until recently the nature of the exchange interaction in this system aroused great debates. First of all, it was due to a complex phase diagram of chromium spacer and strong influence on the sample properties of technological perfection of its structure. Here we made a brief review of the main experimental and theoretical studies on the multilayer systems Fe/Cr/Fe, as well as recounted the results of our own studies (performed with a group of co-authors), which greatly clarify the mechanism of the interlayer interaction in this system.

  6. Helical spin-density wave in Fe/Cr trilayers with perfect interfaces

    SciTech Connect

    Fishman, R.S.

    1998-07-01

    Despite the presence of only collinear, commensurate (C) and incommensurate (I) spin-density waves (SDW`s) in bulk Cr, the interfacial steps in Fe/Cr multilayers are now believed to stabilize a helical (H) SDW within the Cr spacer. Yet H SDW`s were first predicted in an Fe/Cr trilayer with perfect interfaces when the orientation of the Fe moments does not favor C ordering: if the number of Cr monolayers is even (odd) and the Fe moments are pointing in the same (opposite) direction, then a C SDW does not gain any coupling energy. Under these circumstances, a simple model verifies that H ordering is indeed favored over 1 ordering provided that the Fermi surface mismatch is sufficiently small or the temperature sufficiently high.

  7. Large energy product enhancement in perpendicularly coupled MnBi/CoFe magnetic bilayers

    NASA Astrophysics Data System (ADS)

    Gao, T. R.; Fang, L.; Fackler, S.; Maruyama, S.; Zhang, X. H.; Wang, L. L.; Rana, T.; Manchanda, P.; Kashyap, A.; Janicka, K.; Wysocki, A. L.; N'Diaye, A. T.; Arenholz, E.; Borchers, J. A.; Kirby, B. J.; Maranville, B. B.; Sun, K. W.; Kramer, M. J.; Antropov, V. P.; Johnson, D. D.; Skomski, R.; Cui, J.; Takeuchi, I.

    2016-08-01

    We demonstrate substantial enhancement in the energy product of MnBi-based magnets by forming robust ferromagnetic exchange coupling between a MnBi layer and a thin CoFe layer in a unique perpendicular coupling configuration, which provides increased resistance to magnetization reversal. The measured nominal energy product of 172 kJ /m3 at room temperature is the largest value experimentally attained for permanent magnets free of expensive raw materials. Our finding shows that exchange-coupled MnBi/CoFe magnets are a viable option for pursuing rare-earth-free magnets with energy products approaching those containing rare-earth elements.

  8. Transition metal redox and Mn disproportional reaction in LiMn0.5Fe0.5PO4 electrodes cycled with aqueous electrolyte

    NASA Astrophysics Data System (ADS)

    Zhuo, Zengqing; Hu, Jiangtao; Duan, Yandong; Yang, Wanli; Pan, Feng

    2016-07-01

    We performed soft x-ray absorption spectroscopy (sXAS) and a quantitative analysis of the transition metal redox in the LiMn0.5Fe0.5PO4 electrodes upon electrochemical cycling. In order to circumvent the complication of the surface reactions with organic electrolyte at high potential, the LiMn0.5Fe0.5PO4 electrodes are cycled with aqueous electrolyte. The analysis of the transitional metal L-edge spectra allows a quantitative determination of the redox evolution of Mn and Fe during the electrochemical cycling. The sXAS analysis reveals the evolving Mn oxidation states in LiMn0.5Fe0.5PO4. We found that electrochemically inactive Mn2+ is formed on the electrode surface during cycling. Additionally, the signal indicates about 20% concentration of Mn4+ at the charged state, providing a strong experimental evidence of the disproportional reaction of Mn3+ to Mn2+ and Mn4+ on the surface of the charged LiMn0.5Fe0.5PO4 electrodes.

  9. Irradiation-enhanced α' precipitation in model FeCrAl alloys

    DOE PAGESBeta

    Edmondson, Philip D.; Briggs, Samuel A.; Yamamoto, Yukinori; Howard, Richard H.; Sridharan, Kumar; Terrani, Kurt A.; Field, Kevin G.

    2016-02-17

    Model FeCrAl alloys with varying compositions (Fe(10–18)Cr(10–6)Al at.%) have been neutron irradiated at ~ 320 to damage levels of ~ 7 displacements per atom (dpa) to investigate the compositional influence on the formation of irradiation-induced Cr-rich α' precipitates using atom probe tomography. In all alloys, significant number densities of these precipitates were observed. Cluster compositions were investigated and it was found that the average cluster Cr content ranged between 51.1 and 62.5 at.% dependent on initial compositions. This is significantly lower than the Cr-content of α' in binary FeCr alloys. As a result, significant partitioning of the Al from themore » α' precipitates was also observed.« less

  10. Multi-scale analysis of the occurrence of Pb, Cr and Mn in the NIST standards: Urban dust (SRM 1649a) and indoor dust (SRM 2584)

    NASA Astrophysics Data System (ADS)

    Jiang, Mingyu; Nakamatsu, Yuki; Jensen, Keld A.; Utsunomiya, Satoshi

    2014-01-01

    Adverse health effects of ambient particulate matters are closely related to the speciation of the constituting organic matters and toxic metals. To determine multi-parameters of the metal speciation in urban and indoor dusts, we have performed systematic bulk- to nano-scale (“multi-scale”) analysis on the speciation of Pb, Mn, and Cr in two National Institute of Standards and Technology (NIST) standard reference materials (SRMs): urban dust (SRM 1649a) and indoor dust (SRM 2584), utilizing X-ray absorption near-edge structure, powder X-ray diffraction analysis, electron microprobe analysis, scanning electron microscopy, and transmission electron microscopy. Major crystalline phases are quartz, gypsum, kaolinite, and muscovite in SRM 1649a, while quartz, gypsum, calcite, and possibly muscovite (or chabazite) in SRM 2584. A number of Pb sulfate nanoparticles (50-200 nm) occur in SRM 1649a, whereas micron-sized Pb carbonate is present containing various concentrations of Zn and Ti in the complex texture in SRM 2584. Relatively soluble Mn(II) sulfate is the bulk-averaged Mn speciation in SRM 1649a, although discrete Mn sulfate particles are not characterized by individual particle analysis, implying the diluted Mn distribution within other sulfate. In SRM 2584, Mn speciation includes a mixture of oxides and carbonates, and trace Mn in chromite. Chromite (FeCr2O4) is the major Cr speciation in SRM1694a, while unidentified Cr(III) phases with minor chromite and Pb chromate are present in SRM 2584, among which the Pb chromate is composed of Cr(VI). A significant number of the metal-bearing particles are distributed to the submicron-size fraction in the urban dust, SRM 1649a, suggesting that these metal nanoparticles can potentially penetrate into the deep respiratory system. This study demonstrates that multi-scale analysis combining nano and bulk analytical techniques is a powerful approach to investigate the multi-parameters of metal-bearing nanoparticles in

  11. Tunable Magnetic Properties in CuCr2- x Fe x O4 Ceramics by Doping of Fe

    NASA Astrophysics Data System (ADS)

    Zhu, C. M.; Wang, L. G.; Bao, D. L. G. C.; Luo, H.; Tian, Z. M.; Yuan, S. L.

    2016-08-01

    CuCr2- x Fe x O4 ceramics have been successfully synthesized using the sol-gel method for the first time. With pure formation, material structure has been characterized by x-ray diffraction. The samples have been identified as having the spinel structure with formulae CuCr2- x Fe x O4. Micrographs obtained by scanning electron microscopy show the dense microstructure of the samples. The stoichiometric ratio of the ceramics has been measured through energy dispersive spectra. Magnetic properties of CuCr2- x Fe x O4 ceramics have been discussed. Temperature dependence of magnetization presents the gradually increasing irreversible temperature as the content of Fe element increases from x = 0 to 1. Coercive field ( H C), remanent magnetization ( M r), and saturation magnetization ( M S) respectively display the monotonous variation phenomena with increasing content of Fe. The increasing M r, M S and the decreasing H C can be attributed to the change of magnetic exchange interaction because of the doped Fe. It also proves that the magnetic properties of CuCr2- x Fe x O4 ceramics can be effectively tuned by the doping content of Fe.

  12. Magnetostructural transition behavior in Fe-doped Heusler Mn-Ni-In ribbon materials

    NASA Astrophysics Data System (ADS)

    Li, Hongwei; Fang, Yue; Feng, Shutong; Zhai, Qijie; Luo, Zhiping; Zheng, Hongxing

    2016-11-01

    In the present work, we investigated magnetostructural transition behavior in Mn-rich Heusler Mn50-xFexNi41In9 (x=0, 1, 2, 3 at%) ribbon materials. Microstructural observations showed that substituting Mn with Fe in Mn50Ni41In9 led to striking grain refinement from ∼50 μm to 5-10 μm, and formation of a secondary phase when Fe content was increased up to 2 at%. Differential scanning calorimetric and thermomagnetic measurements indicated that a paramagnetic→ferromagnetic transition in austenite occurred first, followed with a weak-magnetic martensitic transition upon cooling for the Mn50-xFexNi41In9 (x=0, 1, 2). In case of Mn47Fe3Ni41In9, the martensitic transformation happened between paramagnetic austenite and weak-magnetic martensite, without the presence of the magnetic transition in austenite. The effective refrigeration capacity of Mn49Fe1Ni41In9 reached 137.1 J kg-1 under a magnetic field change of 30 kOe.

  13. Effect of precipitations on the damping capacity of Fe-13Cr-2.5Mo alloy

    NASA Astrophysics Data System (ADS)

    Hu, Xiaofeng; Li, Xiuyan; Zhang, Bo; Rong, Lijian; Li, Yiyi

    2009-07-01

    The influence of precipitations on the damping capacity of Fe-13Cr-2.5Mo (mass %) based alloys has been investigated in this paper. The damping behaviors were examined by dynamic mechanical analyzer (DMA) at temperature t = 35 °C, vibrate frequency f = 1 Hz and strain amplitude ɛ of 10-6 and 10-3. Field-emission scanning electron microscope (FESEM) with X-ray energy dispersive spectrometer (EDS) was used to observe microstructure and determine the composition of precipitations. The results show that damping capacity of Fe-13Cr-2.5Mo based alloys is more strongly correlated with intragranular precipitation than with grain boundary (GB) precipitation. Fe-Cr-Mo alloy annealed at 1100 °C for 1 h followed by furnace cooling (FC) with relatively fewer intergranular precipitations, exhibits higher damping behavior. With the increase of annealing temperature, the amount of intragranular precipitations increases while damping capacity of Fe-Cr-Mo alloy decreases. Addition of 1.0% Ti obviously inhibits precipitation of GB precipitations, but promotes the intragranular precipitations in the alloy distinctly, so the damping capacity of Fe-Cr-Mo- 1Ti is slightly lower than that of Fe-Cr-Mo alloy. Addition of 1.0% Nb can significantly decrease damping capacity of Fe-Cr-Mo-1Nb at low strain amplitude. But at higher strain amplitude, damping capacity increases more rapidly and Fe- Cr-Mo-1Nb possesses the highest damping capacity. This result reveals that larger amount of precipitations in Fe-Cr-Mo based alloys can interact with dislocations and generate an amplitude-dependent dislocation damping Q-1dis at high strain amplitude.

  14. Transferrin is required for normal distribution of 59Fe and 54Mn in mouse brain.

    PubMed

    Malecki, E A; Cook, B M; Devenyi, A G; Beard, J L; Connor, J R

    1999-11-30

    Hypotransferrinemia (hpx/hpx) is a genetic defect in mice resulting in <1% of normal plasma transferrin (Tf) concentrations; heterozygotes for this mutation (+/hpx) have low circulating Tf concentrations. These mice provide a unique opportunity to examine the role of Tf in Fe and Mn transport in the brain. Twenty weanling wild-type BALB/cJ mice, 15 +/hpx mice, and 12 hpx/hpx mice of both sexes were injected i.v. with either 54MnCl(2) or 59FeCl(3) either 1 h or 1 week before killing at 12 weeks of age. Total brain counts of 54Mn and 59Fe were measured, and regional brain distributions were assessed by autoradiography. Hypotransferrinemia did not affect total brain Mn uptake. However, 1 week after i.v. injection, hpx/hpx mice had less 54Mn in forebrain structures including cerebral cortex, corpus callosum, striatum, and substantia nigra. The +/hpx mice had the highest total brain 59Fe accumulation 1 h after i.v. injection. A striking effect of regional distribution of 59Fe was noted 1 week after injection; in hpx/hpx mice, 59Fe was located primarily in choroid plexus, whereas in +/+ and +/hpx mice 59Fe was widely distributed, with relatively high amounts in cerebral cortex and cerebellum. We interpret these data to mean that Tf is necessary for the transport of Fe but not Mn across the blood-brain barrier, and that there is a Tf-independent uptake mechanism for iron in the choroid plexus. Additionally, these data suggest that endogenous synthesis of Tf is necessary for Fe transport from the choroid plexus. PMID:10561526

  15. Influence of recrystallization on phase separation kinetics of oxide dispersion strengthened Fe Cr Al alloy

    SciTech Connect

    Capdevila, C.; Miller, Michael K; Pimentel, G.; Chao, J.

    2012-01-01

    The effect of different starting microstructures on the kinetics of Fe-rich ({alpha}) and Cr-rich ({alpha}') phase separation during aging of Fe-Cr-Al oxide dispersion strengthened (ODS) alloys has been analyzed with a combination of atom probe tomography and thermoelectric power measurements. The results revealed that the high recrystallization temperature necessary to produce a coarse grained microstructure in Fe-base ODS alloys affects the randomness of Cr-atom distributions and defect density, which consequently affect the phase separation kinetics at low annealing temperatures.

  16. Thermodynamic analysis of chemical compatibility of several compounds with Fe-Cr-Al alloys

    NASA Technical Reports Server (NTRS)

    Misra, Ajay K.

    1993-01-01

    Chemical compatibility between Fe-19.8Cr-4.8Al (weight percent), which is the base composition for the commercial superalloy MA956, and several carbides, borides, nitrides, oxides, and silicides was analyzed from thermodynamic considerations. The effect of addition of minor alloying elements, such as Ti, Y, and Y2O3, to the Fe-Cr-Al alloy on chemical compatibility between the alloy and various compounds was also analyzed. Several chemically compatible compounds that can be potential reinforcement materials and/or interface coating materials for Fe-Cr-Al based composites were identified.

  17. Chemical separation and mass spectrometry of Cr, Fe, Ni, Zn, and Cu in terrestrial and extraterrestrial materials using thermal ionization mass spectrometry.

    PubMed

    Yamakawa, Akane; Yamashita, Katsuyuki; Makishima, Akio; Nakamura, Eizo

    2009-12-01

    A sequential chemical separation technique for Cr, Fe, Ni, Zn, and Cu in terrestrial and extraterrestrial silicate rocks was developed for precise and accurate determination of elemental concentration by the isotope dilution method (ID). The technique uses a combination of cation-anion exchange chromatography and Eichrom nickel specific resin. The method was tested using a variety of matrixes including bulk meteorite (Allende), terrestrial peridotite (JP-1), and basalt (JB-1b). Concentrations of each element was determined by thermal ionization mass spectrometry (TIMS) using W filaments and a Si-B-Al type activator for Cr, Fe, Ni, and Zn and a Re filament and silicic acid-H3PO4 activator for Cu. The method can be used to precisely determine the concentrations of these elements in very small silicate samples, including meteorites, geochemical reference samples, and mineral standards for microprobe analysis. Furthermore, the Cr mass spectrometry procedure developed in this study can be extended to determine the isotopic ratios of 53Cr/52Cr and 54Cr/52Cr with precision of approximately 0.05epsilon and approximately 0.10epsilon (1epsilon = 0.01%), respectively, enabling cosmochemical applications such as high precision Mn-Cr chronology and investigation of nucleosynthetic isotopic anomalies in meteorites. PMID:19886654

  18. Chemical separation and mass spectrometry of Cr, Fe, Ni, Zn, and Cu in terrestrial and extraterrestrial materials using thermal ionization mass spectrometry.

    PubMed

    Yamakawa, Akane; Yamashita, Katsuyuki; Makishima, Akio; Nakamura, Eizo

    2009-12-01

    A sequential chemical separation technique for Cr, Fe, Ni, Zn, and Cu in terrestrial and extraterrestrial silicate rocks was developed for precise and accurate determination of elemental concentration by the isotope dilution method (ID). The technique uses a combination of cation-anion exchange chromatography and Eichrom nickel specific resin. The method was tested using a variety of matrixes including bulk meteorite (Allende), terrestrial peridotite (JP-1), and basalt (JB-1b). Concentrations of each element was determined by thermal ionization mass spectrometry (TIMS) using W filaments and a Si-B-Al type activator for Cr, Fe, Ni, and Zn and a Re filament and silicic acid-H3PO4 activator for Cu. The method can be used to precisely determine the concentrations of these elements in very small silicate samples, including meteorites, geochemical reference samples, and mineral standards for microprobe analysis. Furthermore, the Cr mass spectrometry procedure developed in this study can be extended to determine the isotopic ratios of 53Cr/52Cr and 54Cr/52Cr with precision of approximately 0.05epsilon and approximately 0.10epsilon (1epsilon = 0.01%), respectively, enabling cosmochemical applications such as high precision Mn-Cr chronology and investigation of nucleosynthetic isotopic anomalies in meteorites.

  19. [Models for estimating foliar Fe and Mn Concentration of Armeniaca vulgaris cv. Luntaibaixing using spectral reflectance].

    PubMed

    Hu, Zhen-Zhu; Pan, Cun-De; Wang, Shi-Wei; Guo, Zhi-Chao; Wang, Qing-Tao; Ding, Fan; Li, Yuan

    2014-09-01

    Aimed at providing technology for a rapid nutrition diagnosis system of micronutrients in Armeniaca vulgaris cv. Luntaibaixing, we established an element concentration estimation model for its foliar ferrum (Fe) and manganese (Mn) concentration based on spectrum analysis. The foliar spectrum reflectance at various phenological periods of fruit development under different soil fertility conditions was measured by Unispec-SC spectrometer. By analyzing the correlation of foliar Fe, Mn concentration at various phenological periods of fruit development, the spectrum reflectance Rλ and its first-order differential f' (Rλ), we filtered out its sensitive bands. And we established an element concentration estimation model for its foliar Fe and Mn at various phenological periods of fruit development with the linear regression model. The results showed that the spectral sensitive bands of foliar Fe in fruit setting period were 873 and 874 nm, 375 and 437 nm in fruit core-hardening period, 836 and 837 nm in maturity period and 325 and 1 054 nm in post-harvest period. However, the spectral sensitive bands of Mn were 913 and 1 129 nm, 425 and 970 nm, 390 and 466 nm, 423 and 424 nm, respectively. The Fe and Mn concentration of A. vulgaris cv. Luntaibaixing leaves were the most relevant to the first-order differential f' (RD) of its spectrum reflectance, whose linear spectrum estimation model fitting degree was the highest and reached to a significant or highly significant level. It showed that the spectral sensitive bands of Fe and Mn element varied with different phenological periods of fruit development. The spectrum estimation models for its foliar Fe and Mn concentration could be established with linear model according to its first-order differential f' (Rλ). PMID:25532350

  20. The role of biogenic Fe-Mn oxides formed in situ for arsenic oxidation and adsorption in aquatic ecosystems.

    PubMed

    Bai, Yaohui; Yang, Tingting; Liang, Jinsong; Qu, Jiuhui

    2016-07-01

    As(III&V), Mn(II), and Fe(II) may occur simultaneously in some groundwater and surface water. Studying their redox reactions and interactions is essential to unravel the biogeochemical cycles of these metal ions in aquatic ecosystems and to find effective methods to remove them simultaneously in drinking water treatment. Here, the formation of biogenic Fe-Mn oxides (BFMO, defined as a mixture of biogenic Mn oxide (BMO) and Fe oxide) as well as its oxidation and adsorption of As in a Fe(II)-Mn(II)-As(III&V)-Mn-oxidizing microbe (Pseudomonas sp. QJX-1) system were investigated. Batch experiments and structure characterization revealed that the BFMO was formed via a sequential precipitation of Fe oxide and BMO. The first formed Fe oxide was identified as FeOOH (lepidocrocite) and the latter formed BMO was identified as MnO2 (similar to hexagonal birnessite). In the BFMO mixture, the BMO part was mainly responsible for As(III) oxidation, and the Fe oxide part dominated As adsorption. Remarkably, the BMO could oxidize Fe(II) to form FeOOH, which may improve As adsorption. The optimum Mn(II)/Fe(II) ratio for As removal was approximately 1:3 (mol/mol). Taken together, in Fe(II)-Mn(II)-As(III&V)-Mn-oxidizing microbe ecosystems, the in situ formation of BFMO could eliminate or decrease Fe(II), Mn(II), and As(III&V) species simultaneously. Therefore, based on this study, new approaches may be developed for As removal from water containing high concentrations of Fe(II) and Mn(II). PMID:27088246

  1. The role of biogenic Fe-Mn oxides formed in situ for arsenic oxidation and adsorption in aquatic ecosystems.

    PubMed

    Bai, Yaohui; Yang, Tingting; Liang, Jinsong; Qu, Jiuhui

    2016-07-01

    As(III&V), Mn(II), and Fe(II) may occur simultaneously in some groundwater and surface water. Studying their redox reactions and interactions is essential to unravel the biogeochemical cycles of these metal ions in aquatic ecosystems and to find effective methods to remove them simultaneously in drinking water treatment. Here, the formation of biogenic Fe-Mn oxides (BFMO, defined as a mixture of biogenic Mn oxide (BMO) and Fe oxide) as well as its oxidation and adsorption of As in a Fe(II)-Mn(II)-As(III&V)-Mn-oxidizing microbe (Pseudomonas sp. QJX-1) system were investigated. Batch experiments and structure characterization revealed that the BFMO was formed via a sequential precipitation of Fe oxide and BMO. The first formed Fe oxide was identified as FeOOH (lepidocrocite) and the latter formed BMO was identified as MnO2 (similar to hexagonal birnessite). In the BFMO mixture, the BMO part was mainly responsible for As(III) oxidation, and the Fe oxide part dominated As adsorption. Remarkably, the BMO could oxidize Fe(II) to form FeOOH, which may improve As adsorption. The optimum Mn(II)/Fe(II) ratio for As removal was approximately 1:3 (mol/mol). Taken together, in Fe(II)-Mn(II)-As(III&V)-Mn-oxidizing microbe ecosystems, the in situ formation of BFMO could eliminate or decrease Fe(II), Mn(II), and As(III&V) species simultaneously. Therefore, based on this study, new approaches may be developed for As removal from water containing high concentrations of Fe(II) and Mn(II).

  2. Level density and mechanism of deuteron-induced reactions on Fe>54mn>,>56mn>,>58mn>

    SciTech Connect

    Ramirez, A. P. D.; Voinov, A. V.; Grimes, S. M.; Byun, Y.; Brune, C. R.; Massey, T. N.; Akhtar, S.; Dhakal, S.; Parker, C. E.

    2015-07-06

    Here, deuteron elastic cross sections, as well as neutron, proton, and α-particle emission spectra, from d+54,56,58Fe reactions have been measured with deuteron beam energies of 5, 7, and 9 MeV. Optical model parameters have been tested against our experimental data. The fraction of total reaction cross section responsible for the formation of compound nuclei has been deduced from the angular distributions. The degree of discrepancy between calculated and experimental compound cross sections was found to increase with increasing neutron number. The nuclear level densities of the residual nuclei 55Co, 57Co, 55Fe, 57Fe, 52Mn, and 54Mn have been deduced from the compound double differential cross sections. The Gilbert-Cameron model with Iljinov parameter systematics [A. S. Iljinov and M. V. Mebel, Nucl. Phys. A 543, 517 (1992)] was found to have a good agreement with our results.

  3. Interdiffusion between the L1(2) trialuminides Al66Ti25Mn9 and Al67Ti25Cr8

    NASA Technical Reports Server (NTRS)

    Kumar, K. S.; Whittenberger, J. D.

    1992-01-01

    Concentration-distance profiles obtained from Al66Ti25Mn9/Al67Ti25Cr8 diffusion couples are used to determine the interdiffusion coeffients in the temperature range 1373-1073 K. The couples are treated as pseudobinaries, and the diffusion coefficients are determined using the Matano approach. The results are then used to compute the activation energies for diffusion, and a comparison is made with some existing data for the activation energy for creep of Al22Ti8Fe3.

  4. Mössbauer Investigation of Electrodeposited Sn-Zn, Sn-Cr, Sn-Cr-Zn and Fe-Ni-Cr Coatings

    NASA Astrophysics Data System (ADS)

    Kuzmann, E.; Stichleutner, S.; El-Sharif, M.; Chisholm, C. U.; Sziráki, L.; Homonnay, Z.; Vértes, A.

    2002-06-01

    57Fe and 119Sn CEMS, XRD and electrochemical measurements were used to investigate the effect of the preparation parameters and the components on the structure and phase composition of electrodeposited Fe-Ni-Cr alloys in connection with their corrosion behavior. XRD of the electrodeposits reflect an amorphous-like character. 57Fe CEM spectra of Fe-Ni-Cr electrodeposited samples, prepared in a continuous flow plating plastic circulation cell with variation of current density, electrolyte velocity and temperature, can be evaluated as a doublet associated with a highly disordered paramagnetic solid solution phase. This phase was identified earlier in Fe-Ni-Cr electrodeposits that were prepared by another plating method and contained both ferromagnetic and paramagnetic metastable phases [1]. This is the first time that we have succeeded to prepare Fe-Ni-Cr alloys containing only the metastable paramagnetic phase. The effect of the plating parameters on the structure is also analysed by the quadrupole splitting distribution method. 119Sn CEM spectra of all Sn-containing plated alloys show a broad line envelop which can be decomposed at least into two components. One can be associated with β-tin. The other one can be assigned to an alloy phase. The structure and distribution of microenvironments of these phases depends on the plating parameters especially on the parameters of the reverse pulse applied.

  5. Local field effects in half-metals: A GW study of zincblende CrAs, MnAs, and MnC

    NASA Astrophysics Data System (ADS)

    Damewood, L.; Fong, C. Y.

    2011-03-01

    We used the GW approximation to examine the improvements of the semiconducting gap in three predicted half-metals with the zincblende structure, CrAs, MnAs and MnC, compared to density-functional theory with the generalized gradient approximation. Recognizing the differences in the local field effect between transition metals and insulators, respectively, we modeled one spin channel in a half-metal as metallic having a d character and the oppositely oriented spin channel as insulating. To demonstrate the necessity of treating these three compounds as having a d character, we also applied the GW approximation to CrAs using the nearly free electron model in the conducting channel. We found that CrAs shows the least improvement, while Mn-based half-metals exhibit comparable improvements. Physical explanations for these results are presented.

  6. Release of helium from irradiation damage in Fe?9Cr ferritic alloy

    NASA Astrophysics Data System (ADS)

    Ono, K.; Arakawa, K.; Shibasaki, H.; Kurata, H.; Nakamichi, I.; Yoshida, N.

    2004-08-01

    Thermal desorption of helium from Fe-9Cr and pure Fe which were irradiated with 5 keV He + ions at 85 or 473 K have been studied by thermal desorption spectrometry (TDS) at temperatures from room temperature to 1270 K and related microstructure changes by TEM. It is found that five TDS peaks appear in Fe-9Cr specimen and these peaks are well correlated with microstructure changes. From these results, the five peaks I Cr, II Cr, III Cr, IV Cr and V Cr may be attributed to release of trapped helium atoms by the break-up of vacancy-helium-self-interstitial atom complexes or very tiny loops, glide to the specimen surface or coalescence of interstitial type dislocation loops, shrinkage of dislocation loops, bubble migration to the specimen surface and α-γ phase transformation, respectively. Precipitation of Cr around the loops and bubbles in Fe-9Cr is revealed by STEM-EELS and this could shift the related TDS peaks to higher temperatures.

  7. Magnetic characteristics of a high-layer-number NiFe/FeMn multilayer

    SciTech Connect

    Paterson, G. W. Gonçalves, F. J. T.; McFadzean, S.; Stamps, R. L.; O'Reilly, S.; Bowman, R.

    2015-11-28

    We report the static and dynamic magnetic characteristics of a high-layer-number NiFe/FeMn multilayer test structure with potential applications in broadband absorber and filter devices. To allow fine control over the absorption linewidths and to understand the mechanisms governing the resonances in a tailored structure similar to that expected to be used in real world applications, the multilayer was intentionally designed to have layer thickness and interface roughness variations. Magnetometry measurements show that the sample has complex hysteresis loops with features consistent with single ferromagnetic film reversals. Characterisation by transmission electron microscopy allows us to correlate the magnetic properties with structural features, including the film widths and interface roughnesses. Analysis of resonance frequencies from broadband ferromagnetic resonance measurements as a function of field magnitude and orientation provide values of the local exchange bias, rotatable anisotropy, and uniaxial anisotropy fields for specific layers in the stack and explain the observed mode softening. The linewidths of the multilayer are adjustable around the bias field, approaching twice that seen at larger fields, allowing control over the bandwidth of devices formed from the structure.

  8. Influence of the porewater geochemistry on Fe and Mn assimilation in Laternula elliptica at King George Island (Antarctica)

    NASA Astrophysics Data System (ADS)

    Poigner, Harald; Monien, Patrick; Monien, Donata; Kriews, Michael; Brumsack, Hans-Jürgen; Wilhelms-Dick, Dorothee; Abele, Doris

    2013-12-01

    A high input of lithogenic sediment from glaciers was assumed to be responsible for high Fe and Mn contents in the Antarctic soft shell clam Laternula elliptica at King George Island. Indeed, withdrawal experiments indicated a strong influence of environmental Fe concentrations on Fe contents in bivalve hemolymph, but no significant differences in hemolymph and tissue concentrations were found among two sites of high and lower input of lithogenic debris. Comparing Fe and Mn concentrations of porewater, bottom water, and hemolymph from sampling sites, Mn appears to be assimilated as dissolved species, whereas Fe apparently precipitates as ferrihydrite within the oxic sediment or bottom water layer prior to assimilation by the bivalve. Hence, we attribute the high variability of Fe and Mn accumulation in tissues of L. elliptica around Antarctica to differences in the geochemical environment of the sediment and the resulting Fe and Mn flux across the benthic boundary.

  9. Searching for 0+ states in 50Cr: Implications for the superallowed β decay of 50Mn

    NASA Astrophysics Data System (ADS)

    Leach, K. G.; Garrett, P. E.; Ball, G. C.; Bender, P. C.; Bildstein, V.; Brown, B. A.; Burbadge, C.; Faestermann, T.; Hadinia, B.; Holt, J. D.; Laffoley, A. T.; Jamieson, D. S.; Jigmeddorj, B.; Radich, A. J.; Rand, E. T.; Stroberg, S. R.; Svensson, C. E.; Towner, I. S.; Wirth, H.-F.

    2016-07-01

    A 52Cr(p ,t )50Cr two-neutron pickup reaction was performed using the Q3D magnetic spectrograph at the Maier-Leibnitz-Laboratorium in Garching, Germany. Excited states in 50Cr were observed up to an excitation energy of 5.3 MeV. Despite significantly increased sensitivity and resolution over previous work, no evidence of the previously assigned first excited 0+ state was found. As a result, the 02+ state is reassigned at an excitation energy of Ex=3895.0 (5 ) keV in 50Cr. This reassignment directly impacts direct searches for a nonanalog Fermi β+ decay branch in 50Mn. These results also show better systematic agreement with the theoretical predictions for the 0+ state spectrum in 50Cr using the same formalism as the isospin-symmetry-breaking correction calculations for superallowed nuclei. The experimental data are also compared to ab-initio shell-model predictions using the IM-SRG formalism based on N N and 3 N forces from chiral-EFT in the p f -shell for the first time.

  10. Electronic structure, magnetic properties, and stability of the binary and ternary carbides (Fe,Cr)3C and (Fe,Cr)7C3

    NASA Astrophysics Data System (ADS)

    Konyaeva, M. A.; Medvedeva, N. I.

    2009-10-01

    The structural, electronic, and magnetic properties of the binary and ternary carbides (Fe,Cr)3C and (Fe,Cr)7C3 have been investigated within the ab initio density functional theory. The crystal structure of the binary carbides has been optimized and the preferred positions for replacement of chromium or iron impurities in the corresponding carbides have been determined. The changes in the electronic structure and magnetic properties have been investigated, the formation energies of the ternary carbides as functions of the impurity concentrations have been calculated, and conclusions have been drawn regarding the influence of the impurity on the stability of the carbides under investigation.

  11. Mn, Fe, Zn and As speciation in a fast-growing ferromanganese marine nodule

    SciTech Connect

    Marcus, Matthew A.; Manceau, Alain; Kersten, Michael

    2004-04-01

    The speciation of Mn, Fe, As and Zn in a fast-growing (0.02mm/yr), shallow-marine ferromanganese nodule has been examined by micro X-ray fluorescence, micro X-ray diffraction, and micro X-ray absorption spectroscopy. This nodule exhibits alternating Fe-rich and Mn-rich layers reflecting redox variations in water chemistry. Fe occurs as two-line ferrihydrite. The As is strictly associated with Fe and is mostly pentavalent, with an environment similar to that of As sorbed on or coprecipitated with synthetic ferrihydrite. The Mn is in the form of turbostratic birnessite with {approx} 10 percent trivalent manganese in the layers and probably {approx} 8 percent corner-sharing metal octahedra in the interlayers. The Zn is enriched on the rim of the nodule, associated with Mn. The Zn is completely (>90 percent) tetrahedrally coordinated and sorbed in the interlayers of birnessite on vacant layer Mn sites. The Zn and Mn species are similar to ones found in soils, suggesting common structural principles, despite the differing formation conditions in these systems.

  12. Influence of Cr on the nanoclusters formation and superferromagnetic behavior of Fe-Cr-Nb-B glassy alloys

    SciTech Connect

    Chiriac, H.; Whitmore, L.; Grigoras, M.; Ababei, G.; Stoian, G.; Lupu, N.

    2015-05-07

    High resolution imaging and electron diffraction confirm that in the as-quenched state the structure of Fe{sub 79.7−x}Cr{sub x}Nb{sub 0.3}B{sub 20} (x = 11–13 at. %) melt-spun ribbons is completely amorphous, independent of the Cr content. Energy-dispersive X-ray spectroscopy mapping emphasizes clearly the presence of Fe and Cr clusters varying from approximately 1 to 2–3 nm in size with the increase of Cr content from 11 to 13 at. %. The Fe and Cr atoms segregate the atomic scale to form nanometer sized clusters, influencing strongly the macroscopic magnetic behavior. The Curie temperature of the system, T{sub C}{sup system}, confirmed by the magnetic susceptibility versus temperature measurements, gives the strength of the magnetic interactions between clusters. The inter-cluster interactions are much stronger for lower contents of Cr, the microstructure is less uniform, and T{sub C}{sup system} increases from 290 K for 13 at. % Cr to 330 K for 11.5 at. % Cr. The whole system transforms to a ferromagnetic state through interactions between the clusters. Zero-field cooling and field cooling curves confirm the cluster behavior with a blocking temperature, T{sub b}, of about 250 K. Above T{sub b}, the ribbons behave as a superferromagnetic system, whilst below the blocking temperature a classical ferromagnetic behavior is observed.

  13. Robust room temperature spin injection through Fe|CrAs|GaAs structure

    NASA Astrophysics Data System (ADS)

    Xu P., X.; Zwierzycki, M.; Xia, K.; Kelly P., J.; Turek, I.; Wang E., G.

    2003-03-01

    Electronic spin injection from a metallic ferromagnet into a semiconductor was realized only very recently and with less than 10% efficiency. Even though some theoretical study showed that it is possible to achieve almost 100% spin injection through the Fe|GaAs junction in the ballistic limit. However, the symmetry sensitivity of this injection mechanism makes it very difficult to be realized. To study the spin injection effect of a Fe|CrAs (n)|GaAs structure we calculated a scattering matrix based on first-principles density functional theory. Our results show that the high efficiency of spin injection in a Fe|CrAs(n)|GaAs structure can be realized at room temperature with only a few layers of CrAs. The spin injection efficiency is affected little by the interfacial disorder. The spin-dependent resistance of Fe|CrAs|GaAs junction is also studied.

  14. Magnetic properties of transition metal Mn, Fe and Co dimers on monolayer phosphorene

    NASA Astrophysics Data System (ADS)

    Khan, Imran; Hong, Jisang

    2016-09-01

    We studied the geometries, electronic structure and magnetic properties of substitutional doping and adsorption of transition metal (Mn, Fe and Co) dimers on phosphorene monolayer in the framework of the generalized gradient approximation (GGA) and GGA + U. Electronic band structures and magnetic properties were dependent on the doping type and dopant materials. For Mn and Fe substitutional and adsorption dimers, we obtained semiconducting band structures with spin polarization. However, we found a half-metallic feature in Co substitutional dimer while the Co adsorption dimer showed a semiconducting behavior without any spin polarization. With GGA + U, all the systems showed spin polarized semiconducting band structures except Co adsorption dimer which remained unaffected. The hybridization between transition metal (TM) and phosphorene sheet contributed to suppressing the magnetic moment of TM dimers. For instance, the total magnetic moments of -2.0, 4.24 and 1.28 μ B/cell for Mn, Fe and Co substitutional dimers were obtained while the Mn and Fe adsorption dimers showed magnetic moments of -1.69 and 0.46 μ B/cell. These magnetic moments were enhanced with GGA + U. The same magnetic ground states were obtained both from GGA and GGA + U approaches except for the Mn dimers. We observed that the Mn and Fe substitutional dimers showed an out-of-plane magnetization while an in-plane magnetization was observed in Co substitutional dimer. The Mn adsorption dimer still displayed a perpendicular magnetization whereas the Fe adsorption dimer had an in-plane magnetization. We found that the both GGA and GGA + U showed the same magnetization direction in all the systems.

  15. Magnetic properties of transition metal Mn, Fe and Co dimers on monolayer phosphorene.

    PubMed

    Khan, Imran; Hong, Jisang

    2016-09-23

    We studied the geometries, electronic structure and magnetic properties of substitutional doping and adsorption of transition metal (Mn, Fe and Co) dimers on phosphorene monolayer in the framework of the generalized gradient approximation (GGA) and GGA + U. Electronic band structures and magnetic properties were dependent on the doping type and dopant materials. For Mn and Fe substitutional and adsorption dimers, we obtained semiconducting band structures with spin polarization. However, we found a half-metallic feature in Co substitutional dimer while the Co adsorption dimer showed a semiconducting behavior without any spin polarization. With GGA + U, all the systems showed spin polarized semiconducting band structures except Co adsorption dimer which remained unaffected. The hybridization between transition metal (TM) and phosphorene sheet contributed to suppressing the magnetic moment of TM dimers. For instance, the total magnetic moments of -2.0, 4.24 and 1.28 μ B/cell for Mn, Fe and Co substitutional dimers were obtained while the Mn and Fe adsorption dimers showed magnetic moments of -1.69 and 0.46 μ B/cell. These magnetic moments were enhanced with GGA + U. The same magnetic ground states were obtained both from GGA and GGA + U approaches except for the Mn dimers. We observed that the Mn and Fe substitutional dimers showed an out-of-plane magnetization while an in-plane magnetization was observed in Co substitutional dimer. The Mn adsorption dimer still displayed a perpendicular magnetization whereas the Fe adsorption dimer had an in-plane magnetization. We found that the both GGA and GGA + U showed the same magnetization direction in all the systems.

  16. Magnetic properties of transition metal Mn, Fe and Co dimers on monolayer phosphorene

    NASA Astrophysics Data System (ADS)

    Khan, Imran; Hong, Jisang

    2016-09-01

    We studied the geometries, electronic structure and magnetic properties of substitutional doping and adsorption of transition metal (Mn, Fe and Co) dimers on phosphorene monolayer in the framework of the generalized gradient approximation (GGA) and GGA + U. Electronic band structures and magnetic properties were dependent on the doping type and dopant materials. For Mn and Fe substitutional and adsorption dimers, we obtained semiconducting band structures with spin polarization. However, we found a half-metallic feature in Co substitutional dimer while the Co adsorption dimer showed a semiconducting behavior without any spin polarization. With GGA + U, all the systems showed spin polarized semiconducting band structures except Co adsorption dimer which remained unaffected. The hybridization between transition metal (TM) and phosphorene sheet contributed to suppressing the magnetic moment of TM dimers. For instance, the total magnetic moments of ‑2.0, 4.24 and 1.28 μ B/cell for Mn, Fe and Co substitutional dimers were obtained while the Mn and Fe adsorption dimers showed magnetic moments of ‑1.69 and 0.46 μ B/cell. These magnetic moments were enhanced with GGA + U. The same magnetic ground states were obtained both from GGA and GGA + U approaches except for the Mn dimers. We observed that the Mn and Fe substitutional dimers showed an out-of-plane magnetization while an in-plane magnetization was observed in Co substitutional dimer. The Mn adsorption dimer still displayed a perpendicular magnetization whereas the Fe adsorption dimer had an in-plane magnetization. We found that the both GGA and GGA + U showed the same magnetization direction in all the systems.

  17. Fine structure of Fe-Co-Ga and Fe-Cr-Ga alloys with low Ga content

    SciTech Connect

    Kleinerman, Nadezhda M. Serikov, Vadim V. Vershinin, Aleksandr V. Mushnikov, Nikolai V. Stashkova, Liudmila A.

    2014-10-27

    Investigation of Ga influence on the structure of Fe-Cr and Fe-Co alloys was performed with the use of {sup 57}Fe Mössbauer spectroscopy and X-ray diffraction methods. In the alloys of the Fe-Cr system, doping with Ga handicaps the decomposition of solid solutions, observed in the binary alloys, and increases its stability. In the alloys with Co, Ga also favors the uniformity of solid solutions. The analysis of Mössbauer experiments gives some grounds to conclude that if, owing to liquation, clusterization, or initial stages of phase separation, there exist regions enriched in iron, some amount of Ga atoms prefer to enter the nearest surroundings of iron atoms, thus forming binary Fe-Ga regions (or phases)

  18. Cr(VI) Sorption by Nanosized FeS-Coated Sand

    NASA Astrophysics Data System (ADS)

    Park, M.; Jeong, H. Y.; Lee, S.; Kang, N.; Kim, K. H.; Choi, H. J.

    2015-12-01

    Cr(VI) sorption experiments were conducted as a function of pH (4.7, 7.0 and 9.7) using nanosized FeS-coated sand under anoxic environments. Under the experimental conditions, the sand used, with the FeS content of 0.068 mmol per 1 g sand, completely reduced the initially added Cr(VI) to Cr(III) over the pH range examined. The sorption of the once-reduced Cr(III) varied greatly with the solution pH. By the solution-phase analysis, significant amounts of Cr(III) remained as dissolved species at pH 4.7. On the other hands, dissolved Cr was below the detection limit (0.2 μM) at pH 7.0 and 9.7, indicating the greater sorption of Cr(III) at neutral to basic pH than acidic pH. From Cr-K edge X-ray absorption spectroscopy (XAS) analysis of the solid products, the sorbed Cr was shown to be present predominantly as trivalent state in all samples. Regardless of pH, the second coordination shell around Cr (i.e., the Cr-Cr(Fe) shell) was shown to be located at ~2.6 Å, which was far shorter than those in Cr(III)-bearing model compounds such as Cr(OH)3(s) and [Cr, Fe](OH)3(s). Furthermore, the coordination numbers of the second and third shells in the sorption samples (N = 0.7-1.8) were much lower than those in Cr(OH)3(s) and [Cr, Fe](OH)3(s). Taken together, the sorption of the once-reduced Cr(III) was likely to occur via surface-mediated processes (e.g., surface complexation and/or surface precipitation) rather than the bulk-phase precipitation. Financial support was provided by the "R&D Project on Environmental Management of Geologic CO2 Storage" from the KEITI (Project Number: 2014001810003).

  19. Influence of film composition in quaternary Heusler alloy Co2(Mn,Fe)Si thin films on tunnelling magnetoresistance of Co2(Mn,Fe)Si/MgO-based magnetic tunnel junctions

    NASA Astrophysics Data System (ADS)

    Liu, Hong-xi; Kawami, Takeshi; Moges, Kidist; Uemura, Tetsuya; Yamamoto, Masafumi; Shi, Fengyuan; Voyles, Paul M.

    2015-04-01

    The influence of off-stoichiometry on the half-metallic character of quaternary Heusler alloy thin films of Co2(Mn,Fe)Si (CMFS) was investigated by studying the composition dependence of the tunnelling magnetoresistance (TMR) ratio of fully epitaxial CMFS/MgO/CMFS magnetic tunnel junctions (CMFS MTJs) having Co2(Mnα‧Feβ‧)Si0.84 electrodes with various Mn and Fe compositions. It was found that with (Mn + Fe)-rich electrodes had higher TMR ratios than ones with (Mn + Fe)-deficient electrodes at 4.2 and 290 K. These results indicate that the suppression of Co antisites at nominal Mn/Fe sites is critical to obtaining half-metallic quaternary Co2(Mn,Fe)Si in a similar way as in ternary alloy Co2MnSi. CMFS MTJs with Mn-rich and lightly Fe-doped CMFS electrodes showed giant TMR ratios of 2610% at 4.2 K and 429% at 290 K. These results suggest that Co-based Heusler alloy thin films would be highly applicable to spintronic devices because of their half-metallicity and material diversity arising from not only ternary alloy but also quaternary alloy systems.

  20. Surface modification to improve fireside corrosion resistance of Fe-Cr ferritic steels

    DOEpatents

    Park, Jong-Hee; Natesan, Krishnamurti; Rink, David L.

    2010-03-16

    An article of manufacture and a method for providing an Fe--Cr ferritic steel article of manufacture having a surface layer modification for corrosion resistance. Fe--Cr ferritic steels can be modified to enhance their corrosion resistance to liquid coal ash and other chemical environments, which have chlorides or sulfates containing active species. The steel is modified to form an aluminide/silicide passivating layer to reduce such corrosion.

  1. Heat treatment of NiCrFe alloy to optimize resistance to intergrannular stress corrosion

    DOEpatents

    Steeves, Arthur F.; Bibb, Albert E.

    1984-01-01

    A process of producing a NiCrFe alloy having a high resistance to stress corrosion cracking comprising heating a NiCrFe alloy to a temperature sufficient to enable the carbon present in the alloy body in the form of carbide deposits to enter into solution, rapidly cool the alloy body, and heat the cooled body to a temperature between 1100.degree. to 1500.degree. F. for about 1 to 30 hours.

  2. Heat treatment of NiCrFe alloy 600 to optimize resistance to intergranular stress corrosion

    DOEpatents

    Steeves, A.F.; Bibb, A.E.

    A process of producing a NiCrFe alloy having a high resistance to stress corrosion cracking comprises heating a NiCrFe alloy to a temperature sufficient to enable the carbon present in the alloy body in the form of carbide deposits to enter into solution, rapidly cooling the alloy body, and heating the cooled body to a temperature between 1100 to 1500/sup 0/F for about 1 to 30 hours.

  3. Effect of Mn substitution on the transport properties of co-sputtered Fe{sub 3−x}Mn{sub x}Si epilayers

    SciTech Connect

    Tang, M.; Jin, C.; Bai, H. L.

    2014-11-07

    Motivated by the theoretical calculations that Fe{sub 3−x}Mn{sub x}Si can simultaneously exhibit a high spin polarization with a high Curie temperature to be applied in spintronic devices, and in order to further study the effect of Mn contents on the physical properties of Fe{sub 3−x}Mn{sub x}Si, we have investigated the effect of Mn substitution on the transport properties of epitaxial Fe{sub 3−x}Mn{sub x}Si (0≤x≤1) films systematically. The Fe{sub 3−x}Mn{sub x}Si films were epitaxially grown on MgO(001) plane with 45° rotation. The magnetization for various x shows enhanced irreversibility, implying the antiferromagnetic ordering induced by the substitution of Mn. A metal-semiconductor crossover was observed due to the enhanced disorders of interactions and the local lowering of symmetry induced by the substitution of Mn. The single-domain state in the Fe{sub 3−x}Mn{sub x}Si films leads to twofold symmetric curves of the anisotropic magnetoresistance and planar Hall resistivity.

  4. Atomic scale study of grain boundary segregation before carbide nucleation in Ni-Cr-Fe Alloys

    NASA Astrophysics Data System (ADS)

    Li, Hui; Xia, Shuang; Liu, Wenqing; Liu, Tingguang; Zhou, Bangxin

    2013-08-01

    tendency and Gibbs free energy of C in Alloy 690 is higher than in 304 SS, due to the higher bulk C concentration and the site competition of P atoms which segregate at grain boundary [29,30]. It is imply that the segregation tendency is influenced by the bulk concentration of the segregates. Si atoms slightly segregate at grain boundaries in Alloy 690, but do not segregate at grain boundaries in 304 SS. N and P atoms segregate at grain boundary in 304 SS, and their segregation Gibbs free energy are similar. N atoms may be exhausted by the TiN precipitated in the matrix and can not be observed in the grain boundary of Alloy 690 [19]. Mn atoms deplete at grain boundary in 304 SS. This phenomenon is similar to that of proton irradiation induced segregation in 304 SS [32]. B, C, N, P segregation Gibbs energies are similar both in 304 SS and Alloy 690. B and C atoms segregate at grain boundary both in Alloy 690 and 304 SS, P and N segregate at grain boundary in 304 SS. Si atoms segregate at grain boundary in Alloy 690, but do not segregate at grain boundary in 304 SS. Cr enriches at grain boundary both in Alloy 690 and 304 SS, although carbide does not nucleate. Ni and Fe may segregate, deplete or homogeneously distribute at grain boundary in Alloy 690, but they deplete at grain boundary in 304 SS. C and Cr atoms co-segregate at grain boundaries before carbide nucleation in Alloy 690 and 304 SS. Combination with other results in literatures, the evolution of Cr concentration at grain boundary should be enrichment at grain boundary before carbide nucleation, depletion at grain boundary after carbide precipitation, and healing after obvious growth of carbide. After aging treatment at 500 °C for 0.5 h, the total reduction of grain boundary free energy due to segregation is 27.489 kJ/mol for Alloy 690 and 45.207 kJ/mol for 304.

  5. Hydrogen permeation in FeCrAl alloys for LWR cladding application

    NASA Astrophysics Data System (ADS)

    Hu, Xunxiang; Terrani, Kurt A.; Wirth, Brian D.; Snead, Lance L.

    2015-06-01

    FeCrAl, an advanced oxidation-resistant iron-based alloy class, is a highly prevalent candidate as an accident-tolerant fuel cladding material. Compared with traditional zirconium alloy fuel cladding, increased tritium permeation through FeCrAl fuel cladding to the primary coolant is expected, raising potential safety concerns. In this study, the hydrogen permeability of several FeCrAl alloys was obtained using a static permeation test station, which was calibrated and validated using 304 stainless steel. The high hydrogen permeability of FeCrAl alloys leads to concerns with respect to potentially significant tritium release when used for fuel cladding in LWRs. The total tritium inventory inside the primary coolant of a light water reactor was quantified by applying a 1-dimensional steady state tritium diffusion model to demonstrate the dependence of tritium inventory on fuel cladding type. Furthermore, potential mitigation strategies for tritium release from FeCrAl fuel cladding were discussed and indicate the potential for application of an alumina layer on the inner clad surface to serve as a tritium barrier. More effort is required to develop a robust, economical mitigation strategy for tritium permeation in reactors using FeCrAl clad fuel assemblies.

  6. Hydrogen permeation in FeCrAl alloys for LWR cladding application

    SciTech Connect

    Hu, Xunxiang; Terrani, Kurt A.; Wirth, Brian D.; Snead, Lance L.

    2015-03-19

    FeCrAl is an advanced oxidation-resistant iron-based alloy class, is a highly prevalent candidate as an accident-tolerant fuel cladding material. Compared with traditional zirconium alloy fuel cladding, increased tritium permeation through FeCrAl fuel cladding to the primary coolant is expected, raising potential safety concerns. In our study, the hydrogen permeability of several FeCrAl alloys was obtained using a static permeation test station, which was calibrated and validated using 304 stainless steel. The high hydrogen permeability of FeCrAl alloys leads to concerns with respect to potentially significant tritium release when used for fuel cladding in LWRs. Also, the total tritium inventory inside the primary coolant of a light water reactor was quantified by applying a 1-dimensional steady state tritium diffusion model to demonstrate the dependence of tritium inventory on fuel cladding type. Furthermore, potential mitigation strategies for tritium release from FeCrAl fuel cladding were discussed and indicate the potential for application of an alumina layer on the inner clad surface to serve as a tritium barrier. More effort is required to develop a robust, economical mitigation strategy for tritium permeation in reactors using FeCrAl clad fuel assemblies.

  7. Hydrogen permeation in FeCrAl alloys for LWR cladding application

    DOE PAGESBeta

    Hu, Xunxiang; Terrani, Kurt A.; Wirth, Brian D.; Snead, Lance L.

    2015-03-19

    FeCrAl is an advanced oxidation-resistant iron-based alloy class, is a highly prevalent candidate as an accident-tolerant fuel cladding material. Compared with traditional zirconium alloy fuel cladding, increased tritium permeation through FeCrAl fuel cladding to the primary coolant is expected, raising potential safety concerns. In our study, the hydrogen permeability of several FeCrAl alloys was obtained using a static permeation test station, which was calibrated and validated using 304 stainless steel. The high hydrogen permeability of FeCrAl alloys leads to concerns with respect to potentially significant tritium release when used for fuel cladding in LWRs. Also, the total tritium inventory insidemore » the primary coolant of a light water reactor was quantified by applying a 1-dimensional steady state tritium diffusion model to demonstrate the dependence of tritium inventory on fuel cladding type. Furthermore, potential mitigation strategies for tritium release from FeCrAl fuel cladding were discussed and indicate the potential for application of an alumina layer on the inner clad surface to serve as a tritium barrier. More effort is required to develop a robust, economical mitigation strategy for tritium permeation in reactors using FeCrAl clad fuel assemblies.« less

  8. Cr, Mn, and Ca distributions for olivine in angritic systems: Constraints on the origins of Cr-rich and Ca-poor core olivine in angrite LEW87051

    NASA Technical Reports Server (NTRS)

    Mikouchi, T.; Mckay, G.; Le, L.

    1994-01-01

    Angrite meteorites are a type of basaltic achondrites that are noted for their very old cyrstallization ages (4.55 b.y.) and unusual chemical and mineralogical properties. In spite of great interest, only four angrites have been found. LEW87051 is the smallest one which weighs 0.6 g. It is a porphyritic rock with coarse subhedral to euhedral olivines set in a fine-grained groundmass which clearly represents a crystallized melt. The largest uncertainty about the petrogenesis of LEW87051 is the relationship between the large olivine crystals and the groundmass. Prinz et al. suggests that olivines are xenocrysts, while McKay et al. proposed a fractional cyrstallization model based on experimental studies. However, the crystals have Cr-rich and Ca-poor cores which do not match experimental olivines. Although Jurewicz and McKay tried to explaine the zoning of the rim by diffusion, some features are not explained. There also exists a definite composition boundary of Fe(2+) and MnO between the core and the rim. To clarify the origin of these olivines, we have performed experiments using LEW87051 analogs to measure the effects of oxygen fugacity on distribution coefficients of various elements in an angritic system.

  9. Thermal decomposition study of Mn doped Fe3O4 nanoparticles

    NASA Astrophysics Data System (ADS)

    Malek, Tasmira J.; Chaki, S. H.; Tailor, J. P.; Deshpande, M. P.

    2016-05-01

    Fe3O4 is an excellent magnetic material among iron oxides. It has a cubic inverse spinel structure exhibiting distinguished electric and magnetic properties. In this paper the authors report the synthesis of Mn doped Fe3O4 nanoparticles by wet chemical reduction technique at ambient temperature and its thermal characterization. Ferric chloride hexa-hydrate (FeCl3•6H2O), manganese chloride tetra-hydrate (MnCl2•4H2O) and sodium boro-hydrate (NaBH4) were used for synthesis of Fe3O4 nanoparticles at ambient temperature. The elemental composition of the as-synthesized Mn doped Fe3O4 nanoparticles were determined by energy dispersive analysis of X-rays (EDAX) technique. Thermogravimetric (TG) and differential thermal analysis (DTA) were carried out on the Mn doped Fe3O4 nanoparticles in the temperature range of ambient to 1124 K. The thermo-curves revealed that the particles decompose by four steps. The kinetic parameters were evaluated using non-mechanistic equations for the thermal decomposition.

  10. Synthesis, characterization and stability of Cr(III) and Fe(III) hydroxides.

    PubMed

    Papassiopi, N; Vaxevanidou, K; Christou, C; Karagianni, E; Antipas, G S E

    2014-01-15

    Chromium is a common contaminant of soils and aquifers and constitutes a major environmental problem. In nature, chromium usually exists in the form of two oxidation states, trivalent, Cr(III), which is relatively innocuous for biota and for the aquatic environment, and hexavalent, Cr(VI) which is toxic, carcinogenic and very soluble. Accordingly, the majority of wastewater and groundwater treatment technologies, include a stage where Cr(VI) is reduced to Cr(III), in order to remove chromium from the aqueous phase and bind the element in the form of environmentally stable solid compounds. In the absence of iron the final product is typically of the form Cr(OH)3·xH2O whereas in the presence of iron the precipitate is a mixed Fe(1-x)Crx(OH)3 phase. In this study, we report on the synthesis, characterisation and stability of mixed (Fex,Cr1-x)(OH)3 hydroxides as compared to the stability of Cr(OH)3. We established that the plain Cr(III) hydroxide, abiding to the approximate molecular formula Cr(OH)3·3H2O, was crystalline, highly soluble, i.e. unstable, with a tendency to transform into the stable amorphous hydroxide Cr(OH)3(am) phase. Mixed Fe0.75Cr0.25(OH)3 hydroxides were found to be of the ferrihydrite structure, Fe(OH)3, and we correlated their solubility to that of a solid solution formed by plain ferrihydrite and the amorphous Cr(III) hydroxide. Both our experimental results and thermodynamic calculations indicated that mixed Fe(III)-Cr(III) hydroxides are more effective enhancers of groundwater quality, in comparison to the plain amorphous or crystalline Cr(III) hydroxides, the latter found to have a solubility typically higher than 50μg/l (maximum EU permitted Cr level in drinking water), while the amorphous Cr(OH)3(am) phase was within the drinking water threshold in the range 5.7Fe0.75Cr0.25(OH)3 hydroxides studied were of extended stability in the 4.8

  11. Determination of standard thermodynamic properties of daubreelite (FeCr2S4) in the system Ag-Cr-Fe-S by the solid state galvanic cells method

    NASA Astrophysics Data System (ADS)

    Osadchii, Evgeniy; Voronin, Mikhail; Osadchii, Valentin

    2014-05-01

    Daubreelite is a common mineral in enstatite chondrites, but its thermodynamic properties have not been studied. This greatly complicates the study of the physico - chemical parameters of enstatite chondrites formation in their parent bodies. Analysis of the quaternary system Ag-Cr-Fe-S showed that at temperatures below 423 K can be stable phase association Ag2S + Cr2S3 + FeS2 + FeCr2S4, potential silver which can be defined in a completely solid state galvanic cell: (-) Pt | Ag | RbAg4I5 | Ag2S, Cr2S3, FeS2, FeCr2S4 | Pt (+), with a RbAg4I5 as a solid electrolyte with a specific conductivity of Ag+ ion. The overall potential forming process in the cell corresponds to a chemical reaction: 2Ag + Cr2S3 + FeS2 = Ag2S + FeCr2S4 Gibbs energy of this reaction is associated with the electromotive force of galvanic cells by fundamental equation of thermodynamics ΔrG =-nFE, where n = 2 - the number of electrons in the electrochemical process, F = 96485 C•mol-1 - Faraday constant, and E-electromotive force (emf) of galvanic cell in volts. Temperature dependence of the emf was determined in an electrochemical cell, a device which is described in detail in the works Osadchii and Chareev (2006), and Osadchii and Echmaeva (2007). The results were approximated by a linear dependence of E(T), which corresponds to the condition ΔrCp constant and equal to zero: E(mV)=76.32+0.2296•T, 339

  12. Raman Spectroscopy of Ba(Fe1- x Mn x )2As2

    NASA Astrophysics Data System (ADS)

    Dias, Fabio Teixeira; Pinheiro, Lincoln Brum Leite Gusmão; Jurelo, Alcione Roberto

    2015-04-01

    Raman scattering measurements on iron-pnictide Mn-doped BaFe2As2 single crystals are reported. Single crystals were grown out of a FeAs self-flux using conventional high-temperature solution growth and characterized by X-ray diffraction, atomic force microscopy, and Raman. Raman spectra were obtained at room temperature and 77 K on ab- and a( b) c-planes. Two of four phonon modes allowed by symmetry were found and identified. It was observed that the scattering intensity of A1g mode and the frequencies of the A1g and B1g phonons are dependent upon doping of Mn. The dependence of scattering intensity and frequency of A1g mode on Mn doping might indicate that the Mn ion also occupies the As site.

  13. Dissimilatory Reduction of Cr(VI), Fe(III), and U(VI) by Cellulomonas Isolates

    SciTech Connect

    Smith, William Aaron; Apel, William Arnold; Peyton, B. M.; Petersen, J. N.; Sani, R.

    2002-10-01

    The reduction of Cr(VI), Fe(III), and U(VI) was studied using three recently isolated environmental Cellulomonas sp. (WS01, WS18, and ES5) and a known Cellulomonas strain (Cellulomonas flavigena ATCC 482) under anaerobic, non-growth conditions. In all cases, these cultures were observed to reduce Cr(VI), Fe(III), and U(VI). In 100 h, with lactate as electron donor, the Cellulomonas isolates (500 mg/l total cell protein) reduced nitrilotriacetic acid chelated Fe(III) [Fe(III)-NTA] from 5 mM to less than 2.2 mM, Cr(VI) from 0.2 mM to less than 0.001 mM, and U(VI) from 0.2 mM to less than 0.12 mM. All Cellulomonas isolates also reduced Cr(VI), Fe(III), and U(VI) in the absence of lactate, while no metal reduction was observed in either the cell-free or heat-killed cell controls. This is the first report of Cellulomonas sp. reducing Fe(III) and U(VI). Further, this is the first report of Cellulomonas spp. coupling the oxidation of lactate, or other unknown electron donors in the absence of lactate, to the reduction of Cr(VI), Fe(III), and U(VI).

  14. From solid solution to cluster formation of Fe and Cr in α-Zr

    NASA Astrophysics Data System (ADS)

    Burr, P. A.; Wenman, M. R.; Gault, B.; Moody, M. P.; Ivermark, M.; Rushton, M. J. D.; Preuss, M.; Edwards, L.; Grimes, R. W.

    2015-12-01

    To understand the mechanisms by which the re-solution of Fe and Cr additions increase the corrosion rate of irradiated Zr alloys, the solubility and clustering of Fe and Cr in model binary Zr alloys was investigated using a combination of experimental and modelling techniques - atom probe tomography (APT), x-ray diffraction (XRD), thermoelectric power (TEP) and density functional theory (DFT). Cr occupies both interstitial and substitutional sites in the α-Zr lattice; Fe favours interstitial sites, and a low-symmetry site that was not previously modelled is found to be the most favourable for Fe. Lattice expansion as a function of Fe and Cr content in the α-Zr matrix deviates from Vegard's law and is strongly anisotropic for Fe additions, expanding the c-axis while contracting the a-axis. Matrix content of solutes cannot be reliably estimated from lattice parameter measurements, instead a combination of TEP and APT was employed. Defect clusters form at higher solution concentrations, which induce a smaller lattice strain compared to the dilute defects. In the presence of a Zr vacancy, all two-atom clusters are more soluble than individual point defects and as many as four Fe or three Cr atoms could be accommodated in a single Zr vacancy. The Zr vacancy is critical for the increased apparent solubility of defect clusters; the implications for irradiation induced microstructure changes in Zr alloys are discussed.

  15. Dissimilatory reduction of Cr(VI), Fe(III), and U(VI) by Cellulomonas isolates.

    PubMed

    Sani, R K; Peyton, B M; Smith, W A; Apel, W A; Petersen, J N

    2002-10-01

    The reduction of Cr(VI), Fe(III), and U(VI) was studied using three recently isolated environmental Cellulomonas sp. (WS01, WS18, and ES5) and a known Cellulomonas strain ( Cellulomonas flavigena ATCC 482) under anaerobic, non-growth conditions. In all cases, these cultures were observed to reduce Cr(VI), Fe(III), and U(VI). In 100 h, with lactate as electron donor, the Cellulomonas isolates (500 mg/l total cell protein) reduced nitrilotriacetic acid chelated Fe(III) [Fe(III)-NTA] from 5 mM to less than 2.2 mM, Cr(VI) from 0.2 mM to less than 0.001 mM, and U(VI) from 0.2 mM to less than 0.12 mM. All Cellulomonas isolates also reduced Cr(VI), Fe(III), and U(VI) in the absence of lactate, while no metal reduction was observed in either the cell-free or heat-killed cell controls. This is the first report of Cellulomonas sp. reducing Fe(III) and U(VI). Further, this is the first report of Cellulomonas spp. coupling the oxidation of lactate, or other unknown electron donors in the absence of lactate, to the reduction of Cr(VI), Fe(III), and U(VI).

  16. Importance of doping and frustration in itinerant Fe-doped Cr2Al

    SciTech Connect

    Susner, M. A.; Parker, D. S.; Sefat, A. S.

    2015-05-12

    We performed an experimental and theoretical study comparing the effects of Fe-doping of Cr2Al, an antiferromagnet with a N el temperature of 670 K, with known results on Fe-doping of antiferromagnetic bcc Cr. (Cr1-xFex)2Al materials are found to exhibit a rapid suppression of antiferromagnetic order with the presence of Fe, decreasing TN to 170 K for x=0.10. Antiferromagnetic behavior disappears entirely at x≈0.125 after which point increasing paramagnetic behavior is exhibited. Moreover, this is unlike the effects of Fe doping of bcc antiferromagnetic Cr, in which TN gradually decreases followed by the appearance of a ferromagnetic state. Theoretical calculations explain that the Cr2Al-Fe suppression of magnetic order originates from two effects: the first is band narrowing caused by doping of additional electrons from Fe substitution that weakens itinerant magnetism; the second is magnetic frustration of the Cr itinerant moments in Fe-substituted Cr2Al. In pure-phase Cr2Al, the Cr moments have an antiparallel alignment; however, these are destroyed through Fe substitution and the preference of Fe for parallel alignment with Cr. This is unlike bulk Fe-doped Cr alloys in which the Fe anti-aligns with the Cr atoms, and speaks to the importance of the Al atoms in the magnetic structure of Cr2Al and Fe-doped Cr2Al.

  17. Kinetic-arrest-induced phase coexistence and metastability in (Mn,Fe ) 2(P ,Si )

    NASA Astrophysics Data System (ADS)

    Miao, X. F.; Mitsui, Y.; Dugulan, A. Iulian; Caron, L.; Thang, N. V.; Manuel, P.; Koyama, K.; Takahashi, K.; van Dijk, N. H.; Brück, E.

    2016-09-01

    Neutron diffraction, Mössbauer spectroscopy, magnetometry, and in-field x-ray diffraction are employed to investigate the magnetoelastic phase transition in hexagonal (Mn,Fe ) 2(P ,Si ) compounds. (Mn,Fe ) 2(P ,Si ) compounds undergo for certain compositions a second-order paramagnetic (PM) to a spin-density-wave (SDW) phase transition before further transforming into a ferromagnetic (FM) phase via a first-order phase transition. The SDW-FM transition can be kinetically arrested, causing the coexistence of FM and untransformed SDW phases at low temperatures. Our in-field x-ray diffraction and magnetic relaxation measurements clearly reveal the metastability of the untransformed SDW phase. This unusual magnetic configuration originates from the strong magnetoelastic coupling and the mixed magnetism in hexagonal (Mn,Fe ) 2(P ,Si ) compounds.

  18. First-principles investigation of MnFe2O4

    NASA Astrophysics Data System (ADS)

    Singh, D. J.; Gupta, M.; Gupta, R.

    2002-02-01

    Spinel structure MnFe2O4 is investigated using density functional calculations. The ground state is a high spin ferrimagnet in agreement with experiment. The band structure shows a low carrier density half metal in the fully ordered state, in contrast to experimental characterizations of partially disordered samples as small band gap insulators. However, we find a strong coupling of the energy bands at the Fermi energy to the internal structural parameter u as well as strong effects on the electronic structure upon partial interchange of Fe and Mn atoms. This indicates that the insulating character may be due to Anderson localization associated with the intersite Mn-Fe disorder. This possibility is discussed in terms of the relation between other calculated properties and experimental data.

  19. Spark plasma sintering and microwave electromagnetic properties of MnFe2O4 ceramics

    NASA Astrophysics Data System (ADS)

    Penchal Reddy, M.; Mohamed, A. M. A.; Venkata Ramana, M.; Zhou, X. B.; Huang, Q.

    2015-12-01

    MnFe2O4 ferrite powder was synthesized by a facile one-pot hydrothermal route and then consolidated into dense nanostructured compacts by the spark plasma sintering (SPS) technique. The effect of sintering temperature, on densification, morphology, magnetic and microwave absorption properties was examined. Spark plasma sintering resulted in uniform microstructure, as well as maximum relative density of 98%. The magnetic analysis indicated that the MnFe2O4 ferrite nanoparticles showed ferrimagnetic behavior. Moreover, the dielectric loss and magnetic loss properties of MnFe2O4 ferrite nanoparticles were both enhanced due to its better dipole polarization, interfacial polarization and shape anisotropy. It is believed that such spark plasma sintered ceramic material will be applied widely in microwave absorbing area.

  20. Rotational hysteresis of the exchange anisotropy direction in Co /FeMn thin films

    NASA Astrophysics Data System (ADS)

    Olamit, Justin; Liu, Kai

    2007-05-01

    The effects of rotating an applied field on the exchange anisotropy in Co /FeMn thin films have been investigated. When the applied field is initially along the cooling field direction, the longitudinal hysteresis loop has a maximum coercivity and the transverse hysteresis loop is flat, indicating that the exchange field is along the cooling field direction. When the applied field angle is rotated away and then restored to the original field cooling direction, the exchange anisotropy direction has changed. The rotation of the exchange field direction trails the applied field and is hysteretic. The rotational hysteresis of the exchange field direction is due to the weak anisotropy in thin FeMn layers and decreases with increasing FeMn thickness.

  1. Supramolecular interactions of fullerenes with (Cl)Fe- and Mn porphyrins. A theoretical study.

    PubMed

    Liao, Meng-Sheng; Watts, John D; Huang, Ming-Ju

    2009-08-01

    The electronic structure and bonding in the noncovalent, supramolecular complexes of fullerenes (C(60), C(70)) with (Cl)Fe- and Mn porphyrins [(Cl)FeP, MnP] were investigated in detail with DFT methods. A dispersion correction was made for the fullerene-porphyrin binding energy through an empirical approach. Several density functionals were employed in the calculations in order to obtain reliable results. Our calculated results differ from those obtained in a previous paper (J. Phys. Chem. A, 2005, 109, 3704). The ground state of (Cl)FeP*C(60) is predicted to be high spin (S = 5/2), in agreement with the experimental results. MnP*C(70) is calculated to have a high-spin (S = 5/2) ground state as well; this is similar to (Cl)FeP*C(60), but at variance with the assignment of a low-spin (S = 1/2) state for this complex. According to the calculations, C(70) in MnP*C(70) does not have sufficient ligand-field strength to cause a high- to low-spin state change in MnP. An additional calculation on a comparable, high-spin (Py)MnP complex gives support for the calculated results on MnP*C(70). More detailed experimental investigations are desirable, which might help to resolve the question of the MnP*C(70) electronic structure. The estimated dispersion energies (E(disp)) in the fullerene-porphyrin systems are rather large, ranging from 0.6 to 1.0 eV. Including E(disp) improves the calculated binding energy considerably.

  2. Interfacial strain and defects in asymmetric Fe-Mn oxide hybrid nanoparticles

    NASA Astrophysics Data System (ADS)

    Mayence, Arnaud; Wéry, Madeleine; Tran, Dung Trung; Wetterskog, Erik; Svedlindh, Peter; Tai, Cheuk-Wai; Bergström, Lennart

    2016-07-01

    Asymmetric Fe-Mn oxide hybrid nanoparticles have been obtained by a seed-mediated thermal decomposition-based synthesis route. The use of benzyl ether as the solvent was found to promote the orientational growth of Mn1-xO onto the iron oxide nanocube seeds yielding mainly dimers and trimers whereas 1-octadecene yields large nanoparticles. HRTEM imaging and HAADF-STEM tomography performed on dimers show that the growth of Mn1-xO occurs preferentially along the edges of iron oxide nanocubes where both oxides share a common crystallographic orientation. Fourier filtering and geometric phase analysis of dimers reveal a lattice mismatch of 5% and a large interfacial strain together with a significant concentration of defects. The saturation magnetization is lower and the coercivity is higher for the Fe-Mn oxide hybrid nanoparticles compared to the iron oxide nanocube seeds.Asymmetric Fe-Mn oxide hybrid nanoparticles have been obtained by a seed-mediated thermal decomposition-based synthesis route. The use of benzyl ether as the solvent was found to promote the orientational growth of Mn1-xO onto the iron oxide nanocube seeds yielding mainly dimers and trimers whereas 1-octadecene yields large nanoparticles. HRTEM imaging and HAADF-STEM tomography performed on dimers show that the growth of Mn1-xO occurs preferentially along the edges of iron oxide nanocubes where both oxides share a common crystallographic orientation. Fourier filtering and geometric phase analysis of dimers reveal a lattice mismatch of 5% and a large interfacial strain together with a significant concentration of defects. The saturation magnetization is lower and the coercivity is higher for the Fe-Mn oxide hybrid nanoparticles compared to the iron oxide nanocube seeds. Electronic supplementary information (ESI) available: Materials characterization, powder X-ray diffraction, EFTEM images, EELS spectra, HAADF-STEM. See DOI: 10.1039/c6nr01373b

  3. Structural And Magnetic Properties Of Mn And Zn Doped Fe3O4 Nanoparticles

    NASA Astrophysics Data System (ADS)

    Varshney, Dinesh; Verma, Kavita; Yogi, A.

    2011-07-01

    Mn and Zn doped Fe3O4 nanoparticles of size 7.36 and 12.52 nm were prepared by co precipitation method. X-ray diffraction (XRD) pattern infers that both the samples are in single phase with Fd3m space group, which was further confirmed by Rietveld refinement. Transmission Mössbauer spectra reveals ferrimagnetic nature for Mn doping concentration while into that for Zn doping concentration it shows diamagnetic behaviour. Zn doped nanoparticles shows the superparamagnetic property.

  4. Observation of Precipitation Evolution in Fe-Ni-Mn-Ti-Al Maraging Steel by Atom Probe Tomography

    NASA Astrophysics Data System (ADS)

    Pereloma, E. V.; Stohr, R. A.; Miller, M. K.; Ringer, S. P.

    2009-12-01

    We describe the full decomposition sequence in an Fe-Ni-Mn-Ti-Al maraging steel during isothermal annealing at 550 °C. Following significant pre-precipitation clustering reactions within the supersaturated martensitic solid solution, (Ni,Fe)3Ti and (Ni,Fe)3(Al,Mn) precipitates eventually form after isothermal aging for ~60 seconds. The morphology of the (Ni,Fe)3Ti particles changes gradually during aging from predominantly plate-like to rod-like, and, importantly, Mn and Al were observed to segregate to these precipitate/matrix interfaces. The (Ni,Fe)3(Al,Mn) precipitates occurred at two main locations: uniformly within the matrix and at the periphery of the (Ni,Fe)3Ti particles. We relate this latter mode of precipitation to the Mn-Al segregation.

  5. Oxygen-induced immediate onset of the antiferromagnetic stacking in thin Cr films on Fe(001)

    SciTech Connect

    Berti, Giulia Brambilla, Alberto; Calloni, Alberto; Bussetti, Gianlorenzo; Finazzi, Marco; Duò, Lamberto; Ciccacci, Franco

    2015-04-20

    We investigated the magnetic coupling of ultra-thin Cr films grown at 600 K on a Fe(001)-p(1 × 1)O substrate by means of spin-polarized photoemission spectroscopy. Our findings show that the expected antiferromagnetic stacking of the magnetization in Cr(001) layers occurs right from the first atomic layer at the Cr/Fe interface. This is at variance with all previous observations in similar systems, prepared in oxygen-free conditions, which always reported on a delayed onset of the magnetic oscillations due to the occurrence of significant chemical alloying at the interface, which is substantially absent in our preparation.

  6. Third element effect in the surface zone of Fe-Cr-Al alloys

    NASA Astrophysics Data System (ADS)

    Airiskallio, E.; Nurmi, E.; Heinonen, M. H.; Väyrynen, I. J.; Kokko, K.; Ropo, M.; Punkkinen, M. P. J.; Pitkänen, H.; Alatalo, M.; Kollár, J.; Johansson, B.; Vitos, L.

    2010-01-01

    The third element effect to improve the high temperature corrosion resistance of the low-Al Fe-Cr-Al alloys is suggested to involve a mechanism that boosts the recovering of the Al concentration to the required level in the Al-depleted zone beneath the oxide layer. We propose that the key factor in this mechanism is the coexistent Cr depletion that helps to maintain a sufficient Al content in the depleted zone. Several previous experiments related to our study support that conditions for such a mechanism to be functional prevail in real oxidation processes of Fe-Cr-Al alloys.

  7. Preparation and Mixed Conductivity of Mn-DOPED Bi-Sr-Fe-BASED Perovskite Type Oxides

    NASA Astrophysics Data System (ADS)

    Baek, Doohyun; Takamura, Hitoshi

    2013-07-01

    Bi0.7Sr0.3FeO3-δ (BSF) with perovskite structure and Mn-doped BSFs were prepared by solid-state reaction and their mixed conductivities were discussed based on results of electrical conductivity and oxygen permeation measurement through membranes of those compounds. BSF showed only 2 S/cm at 800 °C suggesting that its charge unbalance is likely to be compensated by generation of oxygen vacancies. However, Mn-doping caused the increase of electrical conductivity and the decrease of oxygen permeation rate, that is, the extent of charge compensation by electron holes increased through Mn-doping.

  8. DFT calculation and experimental investigation of Mn doping effect in Fe16N2

    NASA Astrophysics Data System (ADS)

    Jiang, Yanfeng; Himmetoglu, Burak; Cococcioni, Matteo; Wang, Jian-Ping

    2016-05-01

    An effective dopant to improve the thermal stability of a Fe16N2 permanent magnet is proposed in this paper. It is demonstrated both theoretically and experimentally that manganese is a promising candidate as dopant in Fe16N2 magnet to improve the thermal stability. Firstly, the atomic moments of the Fe ions with respect to N is investigated by using first-principles DFT calculation. Two possible candidates of elements, including Co and Mn, are compared in terms of its preferred position and magnetic coupling mode. It is found that Mn prefers Fe1 position and ferromagnetic coupling in the Fe16N2 lattice. So Mn is considered as a promising dopant in Fe16N2 magnet to improve its thermal stability. Based on theoretical results, experiments are conducted by a cold-crucible method to prepare (Fe1-xMnx) N bulk samples. The samples are thermal treated at different temperatures to observe their thermal stabilities. X-ray diffraction (XRD) and vibrating sample magnetometer (VSM) are characterized on the samples.

  9. Fe:ZnMnSe laser active material properties at room and cryogenic temperature

    NASA Astrophysics Data System (ADS)

    Jelínková, H.; Doroshenko, M. E.; Osiko, V. V.; Němec, M.; Å ulc, J.; Jelínek, M.; Vyhlídal, D.; Kubecek, V.; Čech, M.; Kovalenko, N. O.; Gerasimenko, A. S.

    2016-04-01

    Fe:Zn(1-x)Mn(x)Se solid solution spectroscopic and laser properties were investigated in the temperature range 80- 290 K. Two novel samples with different zinc - manganese (Zn-Mn) ratio described by the Mn content x (0.1 or 0.2) were used and the results were compared to the known Fe:ZnSe crystal. The samples had a broad absorption spectra with the maximum around 3 μm and therefore an Er:YAG laser (2.94 μm, 10 mJ, 120 ns) was used as a pump radiation source. The Fe:ZnMnSe fluorescence spectra are generally broad in the range 3.5 - 5.5 μm. In the case of Fe:ZnMnSe x = 0.1, the fluorescence spectrum at 290 K is ranging from 3.5 to 5.5 μm. Lowering the temperature down to 80 K lead to the spectral narrowing mainly in the mid-IR part, but the fluorescence is still up to 5 μm at 80 K. In the case of Fe:ZnMnSe x = 0.2 the fluorescence is shifted towards mid-IR up to 5.2 μm even at 80 K. The fluorescence lifetime decreases from tens of us at 80 K down to 1 us at 240 K. The laser oscillations were successfully achieved with both novel Fe:ZnMnSe crystals in the temperature range 80- 290 K. In the case of x = 0.1, the central wavelength was ~4.2 μm at 80 K and the temperature increase up to 290 K led to almost linear increase of the wavelength up to ~4.75 μm. The tendency was similar in the case of Fe:ZnMnSe x = 0.2: the output wavelength increased from ~4.3 μm up to ~4.8 μm with the temperature increase from 80 to 290 K. The laser spectral linewidth was about 300 nm. In comparison with the Fe:ZnSe crystal, the laser output wavelength shift toward mid-IR region without any spectrally tunable element in the laser cavity can be clearly observed.

  10. Mixing and non-stoichiometry in Fe-Ni-Cr-Zn-O spinel compounds: density functional theory calculations.

    PubMed

    Andersson, David A; Stanek, Christopher R

    2013-10-01

    Density functional theory (DFT) calculations have been performed on A(2+)B2(3+)O4(2-) (where A(2+) = Fe, Ni or Zn, and B(3+) = Fe or Cr) spinel oxides in order to determine some of their thermodynamic properties. Mixing energies were calculated for Fe3O4-NiFe2O4, Fe3O4-ZnFe2O4, Fe3O4-FeCr2O4, NiFe2O4-ZnFe2O4, NiFe2O4-NiCr2O4, FeCr2O4-NiCr2O4, FeCr2O4-ZnCr2O4 and ZnCr2O4-ZnFe2O4 pseudo-binaries based on special quasi random (SQS) structures to account for cationic disorder. The results generally agree with available experimental data and the rule that two normal or two inverse spinel compounds easily form solid solutions, while inverse-normal spinel mixtures exhibit positive deviation from solid solution behavior (i.e. immiscibility). Even though the NiFe2O4-NiCr2O4 and Fe3O4-FeCr2O4 systems obey this rule, they exhibit additional features with implications for the corresponding phase diagrams. In addition to mixing enthalpies, non-stoichiometry was also considered by calculating the energies of the relevant defect reactions resulting in A, B and O excess (or deficiency). The DFT calculations predict close to zero or slightly exothermic reactions for both A and B excess in a number of spinel compounds.

  11. Large recovery strain in Fe-Mn-Si-based shape memory steels obtained by engineering annealing twin boundaries.

    PubMed

    Wen, Y H; Peng, H B; Raabe, D; Gutierrez-Urrutia, I; Chen, J; Du, Y Y

    2014-01-01

    Shape memory alloys are a unique class of materials that can recover their original shape upon heating after a large deformation. Ti-Ni alloys with a large recovery strain are expensive, while low-cost conventional processed Fe-Mn-Si-based steels suffer from a low recovery strain (<3%). Here we show that the low recovery strain results from interactions between stress-induced martensite and a high density of annealing twin boundaries. Reducing the density of twin boundaries is thus a critical factor for obtaining a large recovery strain in these steels. By significantly suppressing the formation of twin boundaries, we attain a tensile recovery strain of 7.6% in an annealed cast polycrystalline Fe-20.2Mn-5.6Si-8.9Cr-5.0Ni steel (weight%). Further attractiveness of this material lies in its low-cost alloying components and simple synthesis-processing cycle consisting only of casting plus annealing. This enables these steels to be used at a large scale as structural materials with advanced functional properties.

  12. Relationship among grain size, annealing twins and shape memory effect in Fe-Mn-Si based shape memory alloys

    NASA Astrophysics Data System (ADS)

    Wang, Gaixia; Peng, Huabei; Zhang, Chengyan; Wang, Shanling; Wen, Yuhua

    2016-07-01

    In order to clarify the relationship among grain size, annealing twins and the shape memory effect in Fe-Mn-Si based shape memory alloys, the Fe-21.63Mn-5.60Si-9.32Cr-5.38Ni (weight %) alloy with a grain size ranging from 48.9 μm-253.6 μm was obtained by adjusting the heating temperature or heating time after 20% cold-rolling. The densities of grain boundaries and annealing twins increase with a decrease in grain size, whereas the volume fraction and width of stress-induced ɛ martensite after 9% deformation at Ms + 10 K decrease. This result indicates that grain refinement raises the constraint effects of grain boundaries and annealing twins upon martensitic transformation. In this case, the ability to suppress the plastic deformation and facilitate the stress-induced ɛ martensite transformation deteriorates after grain refinement owing to the enhancement of the constraint effects. It is demonstrated by the result that the difference at Ms + 10 K between the critical stress for plastic yielding and that for inducing martensitic transformation is smaller for the specimen with a grain size of 48.9 μm than for the specimen with a grain size of 253.6 μm. Therefore, the shape memory effect declined by decreasing the grain size.

  13. Positron annihilation lifetime measurement of Fe, Fe-10% Cr and Mo irradiated by fission and fusion neutrons

    NASA Astrophysics Data System (ADS)

    Kuramoto, E.; Kikuchi, N.; Takenaka, M.

    1988-07-01

    Positron annihilation lifetime measurements were performed at room temperature in the isochronal annealing experiments for high-purity Fe, Fe-10% Cr and Mo specimens irradiated by fission (KUR) and fusion (RTNS-II) neutrons. The difference between fission and fusion neutron irradiated high-purity Fe was observed in the recovery behaviour of the second component I 2 (interstitial clusters), namely I 2 in the latter (fusion) is more resistant to recovery at high temperatures. The same behaviour was observed in the case of the Mo specimen. These are explained by the high thermal stability of microvoids (the third component I 3) at high temperatures in the fusion case due to the absorption of gas atoms (He and H) produced by nuclear transmutation. In the case of the Fe-10% Cr alloy specimen this tendency was not clearly observed.

  14. Characterization of transparent superconductivity Fe-doped CuCrO2 delafossite oxide

    NASA Astrophysics Data System (ADS)

    Taddee, Chutirat; Kamwanna, Teerasak; Amornkitbamrung, Vittaya

    2016-09-01

    Delafossite CuCr1-xFexO2 (0.0 ≤ x ≤ 0.15) semiconductors were synthesized using a self-combustion urea nitrate process. The effects of Fe concentration on its microstructural, optical, magnetic, and electrical properties were investigated. X-ray diffraction (XRD) analysis results revealed the delafossite structure in all the samples. The lattice spacing of CuCr1-xFexO2 slightly increased with increasing substitution of Fe at the Cr sites. The optical properties measured at room temperature using UV-visible spectroscopy showed a weak absorbability in the visible light and near IR regions. The corresponding direct optical band gap was about 3.61 eV, exhibiting transparency in the visible region. The magnetic hysteresis loop measurements showed that the Fe-doped CuCrO2 samples exhibited ferromagnetic behavior at room temperature. This indicated that the substitution of Fe3+ for Cr3+ produced a mixed effect on the magnetic properties of CuCrO2 delafossite oxide. The temperature dependent resistivity measurements clearly revealed the presence of superconductivity in the CuCr1-xFexO2 with a superconducting transition up to 118 K.

  15. Magnetic properties of metallic glasses based on Fe-Cr from Mössbauer spectroscopy

    NASA Astrophysics Data System (ADS)

    Gwiazda, J.; Mariańska, E.; Oleniacz, J.; Peryt, M.; Zych, W.

    1990-07-01

    Spectra of metallic foils Fe80- x Cr x B2 ( x=6, 10, 15, 20) and Fe60Cr20B12Si8 were measured at range 4.2 K 300 K. Mössbauer data were analysed by Window’s Hesse-Rübartsch’s and Janot’s methods. The influence of the temperature and the Cr-content is discussed. The coefficient B 3/2 in Bloch’s law was calculated. Curie and crystallization temperature were taken from the DTA-DTMG method [1]. For finding the Curie temperature of the sample Fe60Cr20B20 we used ac susceptibility, but this sample is not homogeneous.

  16. 90° magnetic coupling in a NiFe/FeMn/biased NiFe multilayer spin valve component investigated by polarized neutron reflectometry

    SciTech Connect

    Callori, S. J. Bertinshaw, J.; Cortie, D. L.; Cai, J. W. Zhu, T.; Le Brun, A. P.; Klose, F.

    2014-07-21

    We have observed 90° magnetic coupling in a NiFe/FeMn/biased NiFe multilayer system using polarized neutron reflectometry. Magnetometry results show magnetic switching for both the biased and free NiFe layers, the latter of which reverses at low applied fields. As these measurements are only capable of providing information about the total magnetization within a sample, polarized neutron reflectometry was used to investigate the reversal behavior of the NiFe layers individually. Both the non-spin-flip and spin-flip neutron reflectometry signals were tracked around the free NiFe layer hysteresis loop and were used to detail the evolution of the magnetization during reversal. At low magnetic fields near the free NiFe coercive field, a large spin-flip signal was observed, indicating magnetization aligned perpendicular to both the applied field and pinned layer.

  17. Spectro-photometric determinations of Mn, Fe and Cu in aluminum master alloys

    NASA Astrophysics Data System (ADS)

    Rehan; Naveed, A.; Shan, A.; Afzal, M.; Saleem, J.; Noshad, M. A.

    2016-08-01

    Highly reliable, fast and cost effective Spectro-photometric methods have been developed for the determination of Mn, Fe & Cu in aluminum master alloys, based on the development of calibration curves being prepared via laboratory standards. The calibration curves are designed so as to induce maximum sensitivity and minimum instrumental error (Mn 1mg/100ml-2mg/100ml, Fe 0.01mg/100ml-0.2mg/100ml and Cu 2mg/100ml-10mg/ 100ml). The developed Spectro-photometric methods produce accurate results while analyzing Mn, Fe and Cu in certified reference materials. Particularly, these methods are suitable for all types of Al-Mn, Al-Fe and Al-Cu master alloys (5%, 10%, 50% etc. master alloys).Moreover, the sampling practices suggested herein include a reasonable amount of analytical sample, which truly represent the whole lot of a particular master alloy. Successive dilution technique was utilized to meet the calibration curve range. Furthermore, the workout methods were also found suitable for the analysis of said elements in ordinary aluminum alloys. However, it was observed that Cush owed a considerable interference with Fe, the later one may not be accurately measured in the presence of Cu greater than 0.01 %.

  18. Sm-Nd and Mn-Cr Systematics in the Eucrite Caldera

    NASA Astrophysics Data System (ADS)

    Wadhwa, M.; Lugmair, G. W.

    1995-09-01

    ] and indicate that both Sm-Nd systems in these meteorites closed contemporaneously within the uncertainties afforded by the data (i.e. 20 to 30 My for ^147Sm-^143Nd and is greater than or equal to 15 My for ^146Sm-^142Nd). In contrast, the fine resolution of the ^53Mn-^53Cr system paints a different but, nonetheless, totally consistent picture. In spite of a wide range in Mn/Cr ratios from about 0 (Chromite) to about 7 (Px) the ^53Cr/^52Cr ratios in all samples measured (chromite, etched bulk, Px, and silicates) are the same. Although the typical errors are 10 to 12 ppm the range in the ^53Cr/^52Cr excesses is only 1.14 to 1.17 epsilon units (parts in 10^4 above the terrestrial ratio) with an average of 1.15 epsilon. Thus, the slope of the best fit line through these data points is 0 +/-1(2x10^-7). This means that ^53Mn was no longer extant when the Mn-Cr system closed in CAL. When compared to the ^53Mn/^55Mn ratio of 3.6x10^-6 found for CK [5] this indicates that formation of CAL occurred more than or equal to 15 My after that of CK. Similarly, if the angrite parent body [6] formed with the same initial 653Mn/^55Mn as the EPB then the angrites are more than or equal to 10 My older than CAL. Thus the true age of CAL has to be less than or equal to 4.548 Ga. This upper limit is totally consistent with the Sm-Nd results and probably very close to the true age since the lower limit on the obtained ^146Sm/^144Sm ratio will not allow an age much lower than 4.548 Ga. Note, however, that this "age" may well indicate the time of extensive re-crystallization[7], probably from a melt, when the Cr isotopes were totally equilibrated. References: [1] Lugmair G. W. and Marti K. (1977) EPSL, 35, 349. [2] Lugmair G. W. and Galer S. J. G. (1992) GCA, 56, 1673. [3] Lugmair G. W. et al. (1975) EPSL, 27, 79-84. [4] Wadhwa M. and Lugmair G. W. (1995) LPS XXVI, 1453-1454. [5] Lugmair G. W. et al. (1994) LPS XXV, 813-814. [6] Lugmair G. W. et al. (1992) LPS XXIII, 823-824. [7] Boctor N. Z

  19. Synthesis, structures and magnetic properties of the dimorphic Mn2CrSbO6 oxide.

    PubMed

    Dos santos-García, Antonio J; Solana-Madruga, Elena; Ritter, Clemens; Ávila-Brande, David; Fabelo, Oscar; Sáez-Puche, Regino

    2015-06-21

    The perovskite polymorph of Mn(2)CrSbO(6) compound has been synthesized at 8 GPa and 1473 K. It crystallizes in the monoclinic P21/n space group with cell parameters a = 5.2180 (2) Å, b = 5.3710(2) Å, c = 7.5874(1) Å and β = 90.36(1)°. Magnetic susceptibility and magnetization measurements show the simultaneous antiferromagnetic ordering of Mn(2+) and Cr(3+) sublattices below TN = 55 K with a small canting. Low temperature powder neutron diffraction reveals a commensurate magnetic structure with spins confined to the ac-plane and a propagation vector κ = [1/2 0 1/2]. The thermal treatment of this compound induces an irreversible phase transition to the ilmenite polymorph, which has been isolated at 973 K and crystallizes in R3[combining macron] space group with cell parameters a = 5.2084 (4) Å and c = 14.4000 (11) Å. Magnetic susceptibility, magnetization and powder neutron diffraction data confirm the antiferromagnetic helical ordering of spins in an incommensurate magnetic structure with κ = [00 0.46] below 60 K, and the temperature dependence of the propagation vector up to κ = [00 0.54] at about 10 K. PMID:25623228

  20. Synthesis, structures and magnetic properties of the dimorphic Mn2CrSbO6 oxide.

    PubMed

    Dos santos-García, Antonio J; Solana-Madruga, Elena; Ritter, Clemens; Ávila-Brande, David; Fabelo, Oscar; Sáez-Puche, Regino

    2015-06-21

    The perovskite polymorph of Mn(2)CrSbO(6) compound has been synthesized at 8 GPa and 1473 K. It crystallizes in the monoclinic P21/n space group with cell parameters a = 5.2180 (2) Å, b = 5.3710(2) Å, c = 7.5874(1) Å and β = 90.36(1)°. Magnetic susceptibility and magnetization measurements show the simultaneous antiferromagnetic ordering of Mn(2+) and Cr(3+) sublattices below TN = 55 K with a small canting. Low temperature powder neutron diffraction reveals a commensurate magnetic structure with spins confined to the ac-plane and a propagation vector κ = [1/2 0 1/2]. The thermal treatment of this compound induces an irreversible phase transition to the ilmenite polymorph, which has been isolated at 973 K and crystallizes in R3[combining macron] space group with cell parameters a = 5.2084 (4) Å and c = 14.4000 (11) Å. Magnetic susceptibility, magnetization and powder neutron diffraction data confirm the antiferromagnetic helical ordering of spins in an incommensurate magnetic structure with κ = [00 0.46] below 60 K, and the temperature dependence of the propagation vector up to κ = [00 0.54] at about 10 K.

  1. Phase stability of ternary fcc and bcc Fe-Cr-Ni alloys

    NASA Astrophysics Data System (ADS)

    Wróbel, Jan S.; Nguyen-Manh, Duc; Lavrentiev, Mikhail Yu.; Muzyk, Marek; Dudarev, Sergei L.

    2015-01-01

    The phase stability of fcc and bcc magnetic binary Fe-Cr, Fe-Ni, and Cr-Ni alloys, and ternary Fe-Cr-Ni alloys is investigated using a combination of density functional theory (DFT), cluster expansion (CE), and magnetic cluster expansion (MCE) approaches. Energies, magnetic moments, and volumes of more than 500 alloy structures have been evaluated using DFT, and the predicted most stable configurations are compared with experimental observations. Deviations from the Vegard law in fcc Fe-Cr-Ni alloys, resulting from the nonlinear variation of atomic magnetic moments as functions of alloy composition, are observed. The accuracy of the CE model is assessed against the DFT data, where for ternary Fe-Cr-Ni alloys the cross-validation error is found to be less than 12 meV/atom. A set of cluster interaction parameters is defined for each alloy, where it is used for predicting new ordered alloy structures. The fcc Fe2CrNi phase with Cu2NiZn -like crystal structure is predicted to be the global ground state of ternary Fe-Cr-Ni alloys, with the lowest chemical ordering temperature of 650 K. DFT-based Monte Carlo (MC) simulations are applied to the investigation of order-disorder transitions in Fe-Cr-Ni alloys. The enthalpies of formation of ternary alloys predicted by MC simulations at 1600 K, combined with magnetic correction derived from MCE, are in excellent agreement with experimental values measured at 1565 K. The relative stability of fcc and bcc phases is assessed by comparing the free energies of alloy formation. The evaluation of the free energies involved the application of a dedicated algorithm for computing the configurational entropies of the alloys. Chemical order is analyzed, as a function of temperature and composition, in terms of the Warren-Cowley short-range order (SRO) parameters and effective chemical pairwise interactions. In addition to compositions close to binary intermetallic phases CrNi2, FeNi, FeNi3, and FeNi8, pronounced chemical order is found

  2. Adsorption of antimony(V) onto Mn(II)-enriched surfaces of manganese-oxide and FeMn binary oxide.

    PubMed

    Liu, Ruiping; Xu, Wei; He, Zan; Lan, Huachun; Liu, Huijuan; Qu, Jiuhui; Prasai, Tista

    2015-11-01

    Manganese(IV) oxide [Mn(IV)] potentially oxidizes antimony(III) [Sb(III)] to antimony(V) [Sb(V)] and improves Sb removal by FeMn binary oxide (FMBO) through an oxidation-adsorption mechanism. This study focused on the effect of Mn(IV) reductive dissolution by potassium sulfite (K2SO3) on Sb(V) adsorption onto manganese oxide (Mn-oxide) and FMBO. The maximum Sb(V) adsorption (Qmax,Sb(V)) increased from 1.0 to 1.1 mmol g(-1) for FMBO and from 0.4 to 0.6 mmol g(-1) for Mn-oxide after pretreatment with 10 mmol L(-1) K2SO3. The addition of 2.5 mmol L(-1) Mn(2+) also significantly improved Sb(V) adsorption, and the observed Qmax,Sb(V) increased to 1.4 and 1.0 mmol g(-1) for FMBO and Mn-oxide, respectively, with pre-adsorbed Mn(2+). Neither K2SO3 nor Mn(2+) addition had any effect on Sb(V) adsorption onto iron oxide (Fe-oxide). Mn(2+) introduced by either Mn(IV) dissolution or addition tended to form outer-sphere surface complexes with hydroxyl groups on Mn-oxide surfaces (MnOOH). Mn(2+) at 2.5 mmol L(-1) shifted the isoelectric point (pHiep) from 7.5 to 10.2 for FMBO and from 4.8 to 9.2 for Mn-oxide and hence benefited Sb(V) adsorption. The adsorption of Sb(V) onto Mn(2+)-enriched surfaces contributed to the release of Mn(2+), and the X-ray photoelectron spectra also indicated increased binding energy of Mn 2p3/2 after the adsorption of Sb(V) onto K2SO3-pretreated FMBO and Mn-oxide. Sb(V) adsorption involved the formation of inner-sphere complexes and contributed to the release of Mn(2+). In the removal of Sb(III) by Mn-based oxides, the oxidation of Sb(III) to Sb(V) by Mn(IV) oxides had an effect; however, Mn(IV) dissolution and Mn(2+)-enrichment also played an important role.

  3. Assessing the elastic properties and ductility of Fe-Cr-Al alloys from ab initio calculations

    NASA Astrophysics Data System (ADS)

    Nurmi, E.; Wang, G.; Kokko, K.; Vitos, L.

    2016-01-01

    Fe-Al is one of the best corrosion resistant alloys at high temperatures. The flip side of Al addition to Fe is the deterioration of the mechanical properties. This problem can be solved by adding a suitable amount of third alloying component. In the present work, we use ab initio calculations based on density functional theory to study the elastic properties of Fe?Cr?Al? alloys for Al and Cr contents up to 20 at.%. We assess the ductility as a function of chemistry by making use of the semi-empirical correlations between the elastic parameters and mechanical properties. In particular, we derive the bulk modulus to shear modulus ratio and the Cauchy pressure and monitor their trends in terms of chemical composition. The present findings are contrasted with the previously established oxidation resistance of Fe-Cr-Al alloys.

  4. Behavior of Ni, Zn and Cr during low temperature aqueous Fe oxidation processes on Mars

    NASA Astrophysics Data System (ADS)

    Zhao, Yu-Yan S.; McLennan, Scott M.

    2013-05-01

    The behavior of Ni(II), Zn(II) and Cr(III) during the melanterite (FeSO4·7H2O) to hematite (α-Fe2O3) oxidative transformations involving evolution pathways via jarosite ((H3O,K)Fe3(OH)6(SO4)2), schwertmannite (Fe8O8(OH)6(SO4)) and goethite (α-FeOOH) were investigated in an acidic saturated MgSO4 matrix. Results provide important clues about how elevated levels of trace elements are incorporated into the secondary Fe mineralogy assemblages found on Mars and the mechanism for formation of hematitic concretions at Meridiani Planum on Mars. Our results demonstrate that starting at the same concentrations in the initial solution, final amounts of Ni, Zn and Cr in hematite via different pathways are very different. In Path 1 (melanterite → jarosite → hematite), partitioning of Ni, Zn and Cr into jarosite and hematite (formed through dissolution of jarosite) is most likely in the order: Cr > Zn > Ni. In Path 2 (melanterite → schwertmannite → goethite → hematite), schwertmannite and goethite exhibited strong affinities for divalent Ni and Zn. During such a pathway, Ni should accumulate more than Zn by at least a factor of two, and partitioning of Ni, Zn and Cr to the hematite is most likely in the order: Cr > Ni > Zn. Therefore, our results suggest that the high Ni and moderate Zn distribution pattern observed in Meridiani hematitic spherule-bearing samples can be explained best by the schwertmannite-goethite to hematite pathway (Path 2), without need for an additional high Ni source in this region. Although the lack of goethite at Meridiani renders it uncertain if goethite ever served as a precursor to facilitate hematite formation, dehydration of nano-crystalline goethite is thermodynamically favored and cannot be ruled out. On the other hand, if hematitic concretions were formed by dissolution of jarosite (Path 1), then much higher initial Ni/Zn ratios than 1 in initial diagenetic fluids may be necessary to explain the elevated levels of Ni in the spherules

  5. Acoustic emission study of the plastic deformation of quenched and partitioned 35CrMnSiA steel

    NASA Astrophysics Data System (ADS)

    Li, Yang; Xiao, Gui-yong; Chen, Lu-bin; Lu, Yu-peng

    2014-12-01

    Acoustic emission (AE) monitored tensile tests were performed on 35CrMnSiA steel subjected to different heat treatments. The results showed that quenching and partitioning (Q-P) heat treatments enhanced the combined mechanical properties of high strength and high ductility for commercial 35CrMnSiA steel, as compared with traditional heat treatments such as quenching and tempering (Q-T) and austempering (AT). AE signals with high amplitude and high energy were produced during the tensile deformation of 35CrMnSiA steel with retained austenite (RA) in the microstructure (obtained via Q-P and AT heat treatments) due to an austenite-to-martensite phase transformation. Moreover, additional AE signals would not appear again and the mechanical properties would degenerate to a lower level once RA degenerated by tempering for the Q-P treated steel.

  6. Calorimetric Investigation of Thermal Stability of 304H Cu (Fe-17.7Cr-9.3Ni-2.95Cu-0.91Mn-0.58Nb-0.24Si-0.1C-0.12N-Wt Pct) Austenitic Stainless Steel

    NASA Astrophysics Data System (ADS)

    Tripathy, Haraprasanna; Subramanian, Raju; Hajra, Raj Narayan; Rai, Arun Kumar; Rengachari, Mythili; Saibaba, Saroja; Jayakumar, Tammana

    2016-05-01

    The sequence of phase instabilities that take place in a Fe-17.7Cr-9.3Ni-0.58Nb-2.95Cu-0.12N (wt pct) austenitic stainless steel (304H Cu grade) as a function of temperature has been investigated using dynamic calorimetry. The results obtained from this investigation are supplemented by Thermocalc-based equilibrium and Scheil-Gulliver nonequilibrium solidification simulation. The following phase transformation sequence is found upon slow cooling from liquid: L → L + γ → L + γ + MX → γ + MX + δ → γ +MX + M23C6 → γ + MX + M23C6 + Cu. Under slow cooling, the solidification follows austenite + ferrite (AF) mode, which is in accordance with Thermocalc prediction and Scheil-Gulliver simulation. However, higher cooling rates result in skeletal δ-ferrite formation, due to increased segregation tendency of Nb and Cr to segregate to interdendritic liquid. The solidification mode is found to depend on combined Nb + Cu content. Experimental estimates of enthalpy change associated with melting and secondary phase precipitation are also obtained. In addition a semi-quantitative study on the dissolution kinetics of M23C6 type carbides has also been investigated. The standard solution treatment at 1413 K (1140 °C) is found to be adequate to dissolve both Cu and M23C6 into γ-austenite; but the complete dissolution of MX type carbonitrides occurs near the melting region.

  7. ⁵³Mn-⁵³Cr and ²⁶Al-²⁶Mg ages of a feldspathic lithology in polymict ureilites

    SciTech Connect

    Goodrich, Cyrena Anne; Hutcheon, Ian D.; Kita, Noriko T.; Huss, Gary R.; Cohen, Barbara Anne; Keil, Klaus

    2010-07-01

    We report 53Mn–53Cr and 26Al–26Mg isotopic data, obtained by in-situ SIMS analysis, for feldspathic clasts in polymict ureilites DaG 319 and DaG 165. The analyzed clasts belong to the “albitic lithology,” the most abundant population of indigenous feldspathic materials in polymict ureilites, and are highly fractionated igneous assemblages of albitic plagioclase, Fe-rich pyroxenes, phosphates, ilmenite, silica, and Fe(Mn, K, P, Ti)-enriched glass. Glass in DaG 165 clast 19 has extremely high and variable 55Mn/52Cr ratios (500–58,000) and shows correlated 53Cr excesses up to ~ 1500‰, clearly indicating the presence of live 53Mn at the time of formation. The slope of the well-correlated isochron defined by glass and pyroxenes from this clast corresponds to (53Mn/55Mn) = (2.84 ± 0.10) × 10-6 (2σ). Data for less 55Mn/52Cr-enriched glasses from DaG 319 clast B1, as well as phosphates from several other clasts, are consistent with this isochron. The 53Mn/55Mn ratio obtained from the isochron implies that these clasts are 0.70 ± 0.18 Ma younger than the D'Orbigny angrite, corresponding to the absolute age of 4563.72 ± 0.22 Ma. Plagioclase in DaG 319 clast B1 has a fairly constant 27Al/24Mg ratio of ~ 900 and shows resolvable 26Mg excesses of ~ 2‰. The slope of the isochron defined by pyroxene and plagioclase in this clast is (3.0 ± 1.1) × 10-7 (2σ), corresponding to a time difference of 5.4 (-0.3/+0.5) Ma after CAI (assuming the canonical initial 26Al/27Al ratio of 5 × 10-5) and an age 0.5 (-0.3/+0.5) Ma younger than D'Orbigny. Its absolute age (relative to D'Orbigny) is 4563.9 (+ 0.4/-0.5) Ma, in agreement with the 53Mn–53Cr age from clast 19. These data provide the first high

  8. Investigation on the Microstructure and Ductility-Dip Cracking Susceptibility of the Butt Weld Welded with ENiCrFe-7 Nickel-Base Alloy-Covered Electrodes

    NASA Astrophysics Data System (ADS)

    Qin, Renyao; Wang, Huang; He, Guo

    2015-03-01

    The weld metal of the ENiCrFe-7 nickel-based alloy-covered electrodes was investigated in terms of the microstructure, the grain boundary precipitation, and the ductility-dip cracking (DDC) susceptibility. Besides the dendritic gamma-Ni(Cr,Fe) phase, several types of precipitates dispersed on the austenitic matrix were observed, which were determined to be the Nb-rich MC-type carbides with "Chinese script" morphology and size of approximately 3 to 10 µm, the Mn-rich MO-type oxides with size of approximately 1 to 2 µm, and the spherical Al/Ti-rich oxides with size of less than 1 µm. The discontinuous Cr-rich M23C6-type carbides predominantly precipitate on the grain boundaries, which tend to coarsen during reheating but begin to dissolve above approximately 1273 K (1000 °C). The threshold strain for DDC at each temperature tested shows a certain degree of correlation with the grain boundary carbides. The DDC susceptibility increases sharply as the carbides coarsen in the temperature range of 973 K to 1223 K (700 °C to 950 °C). The growth and dissolution of the carbides during the welding heat cycles deteriorate the grain boundaries and increase the DDC susceptibility. The weld metal exhibits the minimum threshold strain of approximately 2.0 pct at 1323 K (1050 °C) and the DTR less than 873 K (600 °C), suggesting that the ENiCrFe-7—covered electrode has less DDC susceptibility than the ERNiCrFe-7 bare electrode but is comparable with the ERNiCrFe-7A.

  9. Preparation, characterization, and phosphate removal and recovery of magnetic MnFe2O4 nano-particles as adsorbents.

    PubMed

    Xia, Shumei; Xu, Xiaoming; Xu, Changsong; Wang, Hongshuai; Zhang, Xiaowei; Liu, Guangmin

    2016-01-01

    Phosphate removal is an important method for controlling eutrophication in bodies of water. Adsorption is an effective phosphate removal approach. In this research, the adsorbent, namely, MnFe2O4, was prepared through the improved co-precipitation method and investigated in terms of phosphate removal. MnFe2O4 was characterized by scanning electron microscopy, vibrating sample magnetometry, X-ray diffraction, and Fourier transform infrared spectroscopy. Phosphate adsorption by MnFe2O4, desorption of adsorbed MnFe2O4 with the regeneration of desorbed MnFe2O4, and phosphate recovery were researched. Experimental results showed that adding the appropriate amount of polyethylene glycol to MnFe2O4 precursors during preparation inhibited the agglomeration of MnFe2O4 between particles because of the magnetic property of MnFe2O4 etc. High crystallinity and strong magnetism were achieved by MnFe2O4 at low temperatures. Average particle size was 5.1 nm. The hysteresis loops confirmed the ferrimagnetic behaviour of MnFe2O4 with a high saturation magnetization (i.e. 26.27 emu/g). The adsorption mechanism of phosphate was mainly physical. The prepared MnFe2O4 had a spinel structure. The proposed technique achieved a phosphate removal rate of 96.06%. A considerable amount of phosphate was desorbed from the adsorbed MnFe2O4 in 15 w/v% NaOH solution. The adsorption capacity of the desorbed MnFe2O4 could be restored to 96.73% in 10 w/v% NaNO3 solution through ion exchange. A sustainable phosphate source was recovered via hydroxyapatite crystallization in the desorption solution, which contained an abundant amount of phosphate as seed for suitable recovery condition. This finding suggested that MnFe2O4 could be a promising adsorbent for efficient phosphate removal.

  10. Preparation, characterization, and phosphate removal and recovery of magnetic MnFe2O4 nano-particles as adsorbents.

    PubMed

    Xia, Shumei; Xu, Xiaoming; Xu, Changsong; Wang, Hongshuai; Zhang, Xiaowei; Liu, Guangmin

    2016-01-01

    Phosphate removal is an important method for controlling eutrophication in bodies of water. Adsorption is an effective phosphate removal approach. In this research, the adsorbent, namely, MnFe2O4, was prepared through the improved co-precipitation method and investigated in terms of phosphate removal. MnFe2O4 was characterized by scanning electron microscopy, vibrating sample magnetometry, X-ray diffraction, and Fourier transform infrared spectroscopy. Phosphate adsorption by MnFe2O4, desorption of adsorbed MnFe2O4 with the regeneration of desorbed MnFe2O4, and phosphate recovery were researched. Experimental results showed that adding the appropriate amount of polyethylene glycol to MnFe2O4 precursors during preparation inhibited the agglomeration of MnFe2O4 between particles because of the magnetic property of MnFe2O4 etc. High crystallinity and strong magnetism were achieved by MnFe2O4 at low temperatures. Average particle size was 5.1 nm. The hysteresis loops confirmed the ferrimagnetic behaviour of MnFe2O4 with a high saturation magnetization (i.e. 26.27 emu/g). The adsorption mechanism of phosphate was mainly physical. The prepared MnFe2O4 had a spinel structure. The proposed technique achieved a phosphate removal rate of 96.06%. A considerable amount of phosphate was desorbed from the adsorbed MnFe2O4 in 15 w/v% NaOH solution. The adsorption capacity of the desorbed MnFe2O4 could be restored to 96.73% in 10 w/v% NaNO3 solution through ion exchange. A sustainable phosphate source was recovered via hydroxyapatite crystallization in the desorption solution, which contained an abundant amount of phosphate as seed for suitable recovery condition. This finding suggested that MnFe2O4 could be a promising adsorbent for efficient phosphate removal. PMID:26292922

  11. Negative impact of oxygen molecular activation on Cr(VI) removal with core-shell Fe@Fe2O3 nanowires.

    PubMed

    Mu, Yi; Wu, Hao; Ai, Zhihui

    2015-11-15

    In this study, we demonstrate that the presence of oxygen molecule can inhibit Cr(VI) removal with core-shell Fe@Fe2O3 nanowires at neutral pH of 6.1. 100% of Cr(VI) removal was achieved by the Fe@Fe2O3 nanowires within 60 min in the anoxic condition, in contrast, only 81.2% of Cr(VI) was sequestrated in the oxic condition. Removal kinetics analysis indicated that the presence of oxygen could inhibit the Cr(VI) removal efficiency by near 3 times. XRD, SEM, and XPS analysis revealed that either the anoxic or oxic Cr(VI) removal was involved with adsorption, reduction, co-precipitation, and re-adsorption processes. More Cr(VI) was bound in a reduced state of Cr(III) in the anoxic process, while a thicker Cr(III)/Fe(III)/Cr(VI) oxyhydroxides shell, leading to inhibiting the electron transfer, was found under the oxic process. The negative impact of oxygen molecule was attributed to the oxygen molecular activation which competed with Cr(VI) adsorbed for the consumption of donor electrons from Fe(0) core and ferrous ions bound on the iron oxides surface under the oxic condition. This study sheds light on the understanding of the fate and transport of Cr(VI) in oxic and anoxic environment, as well provides helpful guide for optimizing Cr(VI) removal conditions in real applications.

  12. Effects of simultaneous boron and nitrogen implantation on microhardness and fatigue properties of Fe-13cr-15ni alloys

    NASA Astrophysics Data System (ADS)

    Rao, G. R.; Lee, E. H.; Chin, B. A.; Mansur, L. K.

    1994-12-01

    Eight complex austenitic stainless steel alloys based on the composition Fe-13Cr-15Ni-2Mo-2Mn-0.2Ti-0.8Si-0.06C were implanted simultaneously with 400-keV B+ and 550-keV N+ ions and were investigated for changes in fatigue properties and surface microhardness. The nearsurface hardness of all eight alloys improved, but the fatigue life of each decreased. These findings were contrary to those obtained in an earlier study using four simple Fe-13Cr-15Ni alloys, where the dual implantation improved fatigue life by up to 250 pct. While unimplanted specimens failed by slip-band crack initiation, it was hypothesized that the dual implantation suppressed slip to the extent that fewer slip-band cracks were initiated and these were subjected to accelerated crack propagation. In addition, grain-boundary cracking was promoted, yielding a lower fatigue life. Support for this hypothesis was obtained by a study of single crystals of Fe-15Cr-15Ni, which were also implanted with B+ and N+. The dual implantation caused a lower fatigue life due to concentration of slip along a few slip bands to relieve applied stress. Evidence of grain-boundary cracking was obtained using the four simple alloys, which were subjected to triple ion implantation with B+, N+, and C+. The triple implantation decreased the fatigue life of the alloys and caused accelerated growth of fewer slip bands and grain-boundary cracking due to suppression of surface slip bands. This study thus shows the existence of an optimum level of strengthening when multiple ion implantation is used to improve the fatigue properties of alloys.

  13. First-principles calculations of the stability and hydrogen storage behavior of C14 Laves phase compound TiCrMn

    NASA Astrophysics Data System (ADS)

    Nong, Zhi-Sheng; Zhu, Jing-Chuan; Yang, Xia-Wei; Cao, Yong; Lai, Zhong-Hong; Liu, Yong; Sun, Wen

    2014-06-01

    The structural, elastic properties, electronic structure and hydrogen storage behavior of TiCrMn with a hexagonal C14 structure were investigated by the first-principles calculations within the frame work of DFT. The calculated lattice constants were consistent with the experimental values, and obtained cohesive energy and formation enthalpy showed TiCrMn is of the structural stability. These results also indicated that Mn atoms would optionally substitute on the Cr sites of TiCr2 phase to form the ternary intermetallic TiCrMn. The five independent elastic constants as well as polycrystalline elastic parameters (bulk modulus B, shear modulus G, Young's modulus E, Poisson's ratio ν and anisotropy value A) were calculated, and then the ductility and elastic anisotropy of TiCrMn were discussed in details. Furthermore, the electronic DOS and charge density distribution of TiCrMn were also calculated, which revealed the underlying mechanism of structural stability and chemical bonding. Finally, the binding energy of hydrogen in hydride TiCrMn(H3) was investigated, confirming the better hydrogen storage behavior of C14 Laves phase TiCrMn.

  14. Influence of FeO and sulfur on solid state reaction between MnO-SiO2-FeO oxides and an Fe-Mn-Si solid alloy during heat treatment at 1473 K

    NASA Astrophysics Data System (ADS)

    Liu, Cheng-song; Yang, Shu-feng; Kim, Kyung-ho; Li, Jing-she; Shibata, Hiroyuki; Kitamura, Shin-ya

    2015-08-01

    To clarify the influence of FeO and sulfur on solid state reaction between an Fe-Mn-Si alloy and MnO-SiO2-FeO oxides under the restricted oxygen diffusion flux, two diffusion couples with different sulfur contents in the oxides were produced and investigated after heat treatment at 1473 K. The experimental results were also compared with previous work in which the oxides contained higher FeO. It was found that although the FeO content in the oxides decreased from 3wt% to 1wt% which was lower than the content corresponding to the equilibrium with molten steel at 1873 K, excess oxygen still diffused from the oxides to solid steel during heat treatment at 1473 K and formed oxide particles. In addition, increasing the sulfur content in the oxides was observed to suppress the diffusion of oxygen between the alloy and the oxides.

  15. The QTAIM approach to chemical bonding between transition metals and carbocyclic rings: a combined experimental and theoretical study of (eta(5)-C5H5)Mn(CO)3, (eta(6)-C6H6)Cr(CO)3, and (E)-{(eta(5)-C5H4)CF=CF(eta(5)-C5H4)}(eta(5)-C5H5)2Fe2.

    PubMed

    Farrugia, Louis J; Evans, Cameron; Lentz, Dieter; Roemer, Max

    2009-01-28

    Experimental charge densities for (C(5)H(5))Mn(CO)(3) (2), (eta(6)-C(6)H(6))Cr(CO)(3) (3), and (E)-{(eta(5)-C(5)H(4))CF=CF(eta(5)-C(5)H(4))}(eta(5)-C(5)H(5))(2)Fe(2) (4) have been obtained by multipole refinement of high-resolution X-ray diffraction data at 100 K. The resultant densities were analyzed using the quantum theory of atoms in molecules (QTAIM). The electronic structures of these and related pi-hydrocarbyl complexes have also been studied by ab initio density functional theory calculations, and a generally good agreement between theory and experiment with respect to the topological parameters was observed. The topological parameters indicate significant metal-ring covalency. A consistent area of disagreement concerns the topology of the metal-ring interactions. It is shown that because of the shared-shell bonding between the metal and the ring carbons, an annulus of very flat density rho and very small wedge rho is formed, which leads to topologically unstable structures close to catastrophe points. This in turn leads to unpredictable numbers of metal-C bond paths for ring sizes greater than four and fewer M-C bond paths than expected on the basis of the formal hapticity. This topological instability is a general feature of metal-pi-hydrocarbyl interactions and means that a localized approach based on individual M-C(ring) bond paths does not provide a definitive picture of the chemical bonding in these systems. However, other QTAIM indicators, such as the virial paths, the delocalization indices, and the source function, clearly demonstrate that for the n-hapto (eta(n)-C(n)H(n))M unit, there is generally a very similar level of chemical bonding for all M-C(ring) interactions, as expected on the basis of chemical experience.

  16. Effects of Mn content on the deformation behavior of Fe-Mn-Al-C TWIP steels — A computational study

    SciTech Connect

    Wang, Yuan; Sun, Xin; Wang, Y. D.; Zbib, Hussein M.

    2015-04-01

    This paper presents a double-slip/double-twin polycrystal plasticity model using finite element solution to investigate the kinetics of deformation twinning of low-to-medium manganese (Mn) twinning-induced plasticity (TWIP) steels. Empirical equations are employed to estimate the stacking fault energy (SFE) of TWIP steels and the critical resolved shear stress (CRSS) for dislocation slip and deformation twinning, respectively. The results suggest that the evolution of twinning in Fe-xMn-1.4Al-0.6C (x=11.5, 13.5, 15.5, 17.5 and 19.5) TWIP steels, and its relation to the Mn content, can explain the effect of Mn on mechanical properties.the stress-strain. By comparing the double-slip/double-twin model to a double-slip model, the predicted results essentially reveal that the interaction behavior between dislocation slip and deformation twinning can lead to an additional work hardening. Also, numerical simulations are carried out to study the influence of boundary conditions on deformation behavior and twin formation. The nucleation and growth of twinning are found to depend on internal properties (e.g., mismatch orientation of grains and stress redistribution) as well as on external constraints (e.g., the applied boundary conditions) of the material.

  17. Synthesis and spectral characterizations of trivalent ions (Cr3+, Fe3+) doped CdO nanopowders

    NASA Astrophysics Data System (ADS)

    Aswani, T.; Babu, B.; Pushpa Manjari, V.; Joyce Stella, R.; Thirumala Rao, G.; Rama Krishna, Ch.; Ravikumar, R. V. S. S. N.

    2014-03-01

    Trivalent transition metal ions (Cr3+, Fe3+) doped CdO nanopowders via sonication in the presence of Sodium lauryl sulfate as stabilizing agent were synthesized and characterized. Powder XRD studies indicate that the obtained CdO has a cubic phase and concluded that the trivalent ions doping induced the lattice constants to change some extent. Optical absorption spectra exhibited the characteristic bands of Cr3+ and Fe3+ ions in octahedral site symmetry. Crystal field (Dq) and inter-electronic repulsion (B and C) parameters are evaluated for Cr3+ doped CdO nanopowders as Dq = 1540, B = 619 and C = 3327 cm-1 and for Fe3+ doped CdO nanopowders Dq = 920, B = 690, C = 2750 cm-1. EPR spectra of the Cr3+ and Fe3+ doped CdO nanopowders exhibited resonances at g = 1.973 and g = 2 respectively which indicate distorted octahedral site for both ions with the host. Photoluminescence spectra shows the emission bands in violet and bluish green regions for Cr3+ doped CdO, ultraviolet and blue emissions for Fe3+ doped CdO nanopowders. The CIE chromaticity coordinates were also evaluated from the emission spectrum. FT-IR spectra indicate the presence of various functional groups of host lattice.

  18. Synthesis of TiB2/Fe-Cr-Al nanocomposite powder.

    PubMed

    Sachan, Ritesh; Park, Jong-Woo

    2008-10-01

    In this study, a route for synthesizing TiB2/Fe-Cr-Al nanocomposite is proposed via high energy ball milling by using directly coarse powders of TiB2, Fe, Cr and Al. Various compositions of these powder mixtures are milled up to 48 hrs to investigate the effect of composition on the crystalline refinement. The crystalline size is analyzed by an X-ray diffractometer for powder samples containing 30 to 100 wt% TiB2 (the rest of the powder consists of Fe-20 wt%Cr-5 wt%Al composition). The crystalline size after 48 hrs of ball milling decreases with increasing TiB2, and then again increases after reaching a minimum value of 18 nm at 70% TiB2. By transmission electron microscopic analysis, it is confirmed that particles of TiB2 are significantly reduced and finely dispersed in the Fe-Cr-Al matrix. The particle size of TiB2 is found around 20-25 nm, reinforced in the matrix. Considering the results of this study, the proposed mechanical milling route can be recommended as a promising way for fabrication of TiB2/Fe-Cr-Al nanocomposite powder. PMID:19198473

  19. Charge and magnetic states of Mn-, Fe-, and Co-doped monolayer MoS{sub 2}

    SciTech Connect

    Lin, Xianqing; Ni, Jun

    2014-07-28

    First-principles calculations have been performed to investigate the electronic and magnetic properties of monolayer MoS{sub 2} substitutionally doped with Mn, Fe, and Co in possible charge states (q). We find that the Mn, Fe, and Co dopants substituting for a Mo atom in monolayer MoS{sub 2} (Mn@Mo, Fe@Mo, and Co@Mo) are all magnetic in their neutral and charge states except in the highest positive charge states. Mn@Mo, Fe@Mo, and Co@Mo have the same highest negative charge states of q=−2 for chemical potential of electron just below the conduction band minimum, which corresponds to the electron doping. In the q=−2 state, Mn@Mo has a much larger magnetic moment than its neutral state with the antiferromagnetic coupling between the Mn dopant and its neighboring S atoms maintained, while Fe@Mo and Co@Mo have equal or smaller magnetic moments than their neutral states. The possible charge states of Mn@Mo, Fe@Mo, and Co@Mo and the variation of the magnetic moments for different dopants and charge states are due to the change of the occupation and energy of the anti-bonding defect levels in the band gap. The rich magnetic properties of the neutral and charge states suggest possible realization of the substitutionally Mn-, Fe-, and Co-doped monolayer MoS{sub 2} as dilute magnetic semiconductors.

  20. Microstructure and degradation behavior of forged Fe-Mn-Si alloys

    NASA Astrophysics Data System (ADS)

    Xu, Zhigang; Hodgson, Michael A.; Cao, Peng

    2015-03-01

    This work presents a comparative study of a series of Fe-Mn-Si alloys proposed as degradable biomaterials for medical applications. Five Fe-28wt.%Mn-xSi (where x = 0 to 8 wt.%) alloys were fabricated by an arc-melting method. All the as-cast alloys were subsequently subjected to homogenization treatment and hot forging. The microstructure and phase constituents were investigated. It is found that the grain size of the as-forged alloys ranged approximately from 30 to 50 μm. The as-forged Fe-Mn-Si alloys containing Si from 2 to 6 wt.% was comprised of duplex martensitic ɛ and austenitic γ phases; however, the Si-free and 8 wt.% Si alloys only consisted of a single γ phase. After 30 days of static immersion test in a simulated body fluid (SBF) medium, it is found that pitting and general corrosion occur on the sample surfaces. Potentiodynamic analysis reveals that the degradation rate of the Fe-Mn-Si alloys increased gradually with Si content up to 6 wt.%, beyond which the degradation slows down.

  1. Microstructural, mechanical, corrosion and cytotoxicity characterization of the hot forged FeMn30(wt.%) alloy.

    PubMed

    Čapek, Jaroslav; Kubásek, Jiří; Vojtěch, Dalibor; Jablonská, Eva; Lipov, Jan; Ruml, Tomáš

    2016-01-01

    An interest in biodegradable metallic materials has been increasing in the last two decades. Besides magnesium based materials, iron-manganese alloys have been considered as possible candidates for fabrication of biodegradable stents and orthopedic implants. In this study, we prepared a hot forged FeMn30 (wt.%) alloy and investigated its microstructural, mechanical and corrosion characteristics as well as cytotoxicity towards mouse L 929 fibroblasts. The obtained results were compared with those of iron. The FeMn30 alloy was composed of antiferromagnetic γ-austenite and ε-martensite phases and possessed better mechanical properties than iron and even that of 316 L steel. The potentiodynamic measurements in simulated body fluids showed that alloying with manganese lowered the free corrosion potential and enhanced the corrosion rate, compared to iron. On the other hand, the corrosion rate of FeMn30 obtained by a semi-static immersion test was significantly lower than that of iron, most likely due to a higher degree of alkalization in sample surrounding. The presence of manganese in the alloy slightly enhanced toxicity towards the L 929 cells; however, the toxicity did not exceed the allowed limit and FeMn30 alloy fulfilled the requirements of the ISO 10993-5 standard. PMID:26478385

  2. Effect of Fe doping on the electrochemical capacitor behavior of MnO2 nanocrystals

    NASA Astrophysics Data System (ADS)

    Poonguzhali, R.; Shanmugam, N.; Gobi, R.; Senthilkumar, A.; Viruthagiri, G.; Kannadasan, N.

    2015-10-01

    In this work, the influence of Fe doping on the capacitance behavior of MnO2 nanoparticles synthesized by chemical precipitation was investigated. During the doping process the concentration of Fe was increased from 0.025 M to 0.125 M in steps of 0.025 M. The products obtained were characterized by X-ray diffraction, Fourier infrared spectroscopy, scanning electron microscopy and N2 adsorption-desorption isotherms. To demonstrate the suitability of Fe-doped MnO2 for capacitor applications, cyclic voltammetry, galvanostatic charge-discharge and electrochemical impedance were recorded. Among the different levels of doping, the specific capacitance of 912 F/g was delivered by 0.075 M of Fe-doped MnO2 at a scan rate of 10 mV/s, which is almost more than fourfold that of the bare MnO2 electrode (210 F/g). Moreover, for the same concentration the charge, discharge studies revealed the highest specific capacitance of 1084 F/g at a current density of 10 A/g.

  3. Bainitic microstructures formed by split isothermal transformation in an Fe-C-Si-Mn-Mo steel

    SciTech Connect

    Ali, A.

    1996-05-01

    Effect of split isothermal transformations (SITs) on bainitic microstructure has been studied in an Fe-C-Si-Mn-Mo steel by optical and transmission electron microscopy. Split isothermal transformations caused the spheroidization and coalescence of bainitic ferrite subunits, suggesting that bainite probably formed by a displacive transformation mechanism.

  4. The Formation of Crystal Defects in a Fe-Mn-Si Alloy Under Cyclic Martensitic Transformations.

    PubMed

    Bondar, Vladimir I; Danilchenko, Vitaliy E; Iakovlev, Viktor E

    2016-12-01

    Formation of crystalline defects due to cyclic martensitic transformations (CMT) in the iron-manganese Fe-18 wt.% Mn-2 wt.% Si alloy was investigated using X-ray diffractometry. Conditions for accumulation of fragment sub-boundaries with low-angle misorientations and chaotic stacking faults in crystal lattice of austenite and ε-martensite were analyzed.

  5. Microstructural, mechanical, corrosion and cytotoxicity characterization of the hot forged FeMn30(wt.%) alloy.

    PubMed

    Čapek, Jaroslav; Kubásek, Jiří; Vojtěch, Dalibor; Jablonská, Eva; Lipov, Jan; Ruml, Tomáš

    2016-01-01

    An interest in biodegradable metallic materials has been increasing in the last two decades. Besides magnesium based materials, iron-manganese alloys have been considered as possible candidates for fabrication of biodegradable stents and orthopedic implants. In this study, we prepared a hot forged FeMn30 (wt.%) alloy and investigated its microstructural, mechanical and corrosion characteristics as well as cytotoxicity towards mouse L 929 fibroblasts. The obtained results were compared with those of iron. The FeMn30 alloy was composed of antiferromagnetic γ-austenite and ε-martensite phases and possessed better mechanical properties than iron and even that of 316 L steel. The potentiodynamic measurements in simulated body fluids showed that alloying with manganese lowered the free corrosion potential and enhanced the corrosion rate, compared to iron. On the other hand, the corrosion rate of FeMn30 obtained by a semi-static immersion test was significantly lower than that of iron, most likely due to a higher degree of alkalization in sample surrounding. The presence of manganese in the alloy slightly enhanced toxicity towards the L 929 cells; however, the toxicity did not exceed the allowed limit and FeMn30 alloy fulfilled the requirements of the ISO 10993-5 standard.

  6. Superhalogen Behavior of FeO4 MnO_4

    NASA Astrophysics Data System (ADS)

    Gutsev, G. L.; Khanna, S. N.; Jena, P.; Rao, B. K.

    2000-03-01

    Superhalogens are a class of cluster compounds that possess electron affinities in excess of 3.6 eV which is the electron affinity of chlorine, the most electronegative element in the periodic table. For clusters containing oxygen, a superhalogen has to satisfy the composition MO_n, where 2n=k+1. Here k is the maximal valence of the central atom M and n is the number of oxygen atoms. This requirement is fulfilled for MnO4 as the maximal valence of Mn is 7. However, FeO4 should be a closed shell system as the maximal valence of Fe is 8. Consequently, it should possess a relatively low electron affinity. We have performed self-consistent calculations of the total energy and geometry of FeO4 and MnO4 clusters in the neutral and anionic configurations using gradient corrected density functional theory and molecular orbital approach. The electron affinity of MnO4 was found to be 5 eV and as expected, is a superhalogen. Contrary to expectation, FeO4 too was found to have a large electron affinity, namely 3.8 eV and thus, belongs to the superhalogen class. The origin of this large electron affinity of a closed shell system is shown to be a manifestation of the special bonding characterstic of d-electron systems.

  7. Elasticity and magnetocaloric effect in MnFe4Si3

    DOE PAGESBeta

    Herlitschke, Marcus; Klobes, B.; Sergueev, I.; Hering, Paul; Persson, Joerg; Hermann, Raphael P.

    2016-03-16

    The room temperature magnetocaloric material MnFe4Si3 was investigated with nuclear inelastic scattering (NIS) and resonant ultrasound spectroscopy (RUS) at different temperatures and applied magnetic fields in order to assess the infuence of the magnetic transition and the magnetocaloric effect on the lattice dynamics. The NIS data give access to phonons with energies above 3 meV, whereas RUS probes the elasticity of the material in the MHz frequency range and thus low energy, ~5 neV, phonon modes. A significant infuence of the magnetic transition on the lattice dynamics is observed only in the low energy region. Here, MnFe4Si3 and other compoundsmore » in the Mn5-xFexSi3 series were also investigated with vibrating sample magnetometry, resistivity measurements and Moessbauer spectroscopy in order to study the magnetic transitions and to complement the obtained results on the lattice dynamics.« less

  8. Room temperature ferromagnetism in Mn- and Fe-doped indium tin oxide thin films

    NASA Astrophysics Data System (ADS)

    Venkatesan, M.; Gunning, R. D.; Stamenov, P.; Coey, J. M. D.

    2008-04-01

    Undoped and transition-metal doped indium tin oxide films have been grown by pulsed laser deposition technique, on single crystalline c-plane (0001) and r-plane (1102) sapphire substrates maintained at 500-850°C. Magnetization measurements of films deposited at different temperatures indicate that ferromagnetism appears for deposition temperatures, Tdep>600°C, with the highest moment for films deposited around 750°C. Qualitative different ferromagnetic behavior has been observed at room temperature in Fe- and Mn-doped thin films. The stable, hysteretic ferromagnetism of the Fe-doped films is due to the presence of magnetite, as seen in transmission Mössbauer spectra. The Mn-doped films show anhysteretic ferromagnetism which decays over time. It is somehow intrinsic, but not due to the Mn ions, which remains paramagnetic down to 4K. No anomalous Hall effect is observed.

  9. Effect of CoFe insertion in Co{sub 2}MnSi/CoFe/n-GaAs junctions on spin injection properties

    SciTech Connect

    Ebina, Yuya; Akiho, Takafumi; Liu, Hong-xi; Yamamoto, Masafumi; Uemura, Tetsuya

    2014-04-28

    The CoFe thickness (t{sub CoFe}) dependence of spin injection efficiency was investigated for Co{sub 2}MnSi/CoFe/n-GaAs junctions. The ΔV{sub NL}/I value, which is a measure of spin injection efficiency, strongly depended on t{sub CoFe}, where ΔV{sub NL} is the amplitude of a nonlocal spin-valve signal, and I is an injection current. Importantly, the maximum value of ΔV{sub NL}/I for a Co{sub 2}MnSi/CoFe/n-GaAs junction was one order of magnitude higher than that for a CoFe/n-GaAs junction, indicating that a Co{sub 2}MnSi electrode works as a highly polarized spin source. No clear spin signal, on the other hand, was observed for a Co{sub 2}MnSi/n-GaAs junction due to diffusion of Mn atoms into the GaAs channel. Secondary ion mass spectrometry analysis indicated that the CoFe insertion effectively suppressed the diffusion of Mn into GaAs, resulting in improved spin injection properties compared with those for a Co{sub 2}MnSi/n-GaAs junction.

  10. Influence of alloy content and a cerium surface treatment on the oxidation behavior of Fe-Cr ferritic stainless steels

    SciTech Connect

    Alman, D.E.; Jablonski, P.D.

    2006-01-01

    The cost of solid oxide fuel cells (SOFC) can be significantly reduced by using interconnects made from ferritic stainless steels. In fact, several alloys have been developed specifically for this application (Crofer 22APU and Hitachi ZMG323). However, these steels lack environmental stability in SOFC environments, and as a result, degrade the performance of the SOFC. A steel interconnect can contribute to performance degradation through: (i) Cr poisoning of electrochemically active sites within the cathode; (ii) formation of non-conductive oxides, such as SiO2 or Al2O3 from residual or minor alloying elements, at the base metal-oxide scale interface; and/or (iii) excessive oxide scale growth, which may also retard electrical conductivity. Consequently, there has been considerable attention on developing coatings to protect steel interconnects in SOFC environments and controlling trace elements during alloy production. Recently, we have reported on the development of a Cerium surface treatment that improves the oxidation behavior of a variety alloys, including Crofer 22APU [1-5]. Initial results indicated that the treatment may improve the performance of Crofer 22APU for SOFC application by: (i) retarding scale growth resulting in a thinner oxide scale; and (ii) suppressing the formation of a deleterious continuous SiO2 layer that can form at the metal-oxide scale interface in materials with high residual Si content [5]. Crofer 22 APU contains Fe-22Cr-0.5Mn-0.1Ti (weight percent). Depending on current market prices and the purity of raw materials utilized for ingot production, Cr can contribute upwards of 90 percent of the raw materials cost. The present research was undertaken to determine the influence of Cr content and minor element additions, especially Ti, on the effectiveness of the Ce surface treatment. Particular emphasis is placed on the behavior of low Cr alloys.

  11. Exchange bias effects in Heusler alloy Ni2MnAl/Fe bilayers

    NASA Astrophysics Data System (ADS)

    Tsuchiya, Tomoki; Kubota, Takahide; Sugiyama, Tomoko; Huminiuc, Teodor; Hirohata, Atsufumi; Takanashi, Koki

    2016-06-01

    Ni2MnAl Heusler alloy thin films were epitaxially grown on MgO(1 0 0) single crystal substrates by ultra-high-vacuum magnetron sputtering technique. X-ray diffraction and transmission electron microscopy observation revealed that the structures of all the Ni2MnAl thin films were B2-ordered regardless of the deposition temperature ranging from room temperature to 600 °C. The temperature dependence of electrical resistivity showed a kink about 280 K, which was consistent with a reported value of the Néel temperature for antiferromagnetic B2-Ni2MnAl. The magnetization curves of Ni2MnAl/Fe bilayer samples showed a shift caused by the interfacial exchange interaction at 10 K. The maximum value of the exchange bias field H ex was 55 Oe corresponding to the exchange coupling energy J k of 0.03 erg cm-2.

  12. Hall Effect in Different Magnetic Phases of Fe-Rich γ-FeNiCr Alloys

    NASA Astrophysics Data System (ADS)

    Sinha, G.; Majudmar, A. K.

    In this paper we present the Hall effect data of Fe80-xNixCr20(14<=x<=30) alloys in four different magnetic phases within the fcc γ-phase. In the spin-glass (SG) phase (x=19) the nonlinear behaviour of the Hall resistivity (ρH) with field arises from the spin-orbit scattering. The temperature variation of ρH shows broad peaks around Tg for lower fields (<0.1 T) but they disappear at higher fields (1 T). We separate the ordinary (OHC) and the extra-ordinary (EHC) Hall coefficients in the ferromagnetic sample (x=30) and show their temperature variation. In the reentrant spin-glass (RSG) (x=26), again ρH shows a nonlinear variation with field. The temperature variation of ρH shows anomaly near both Tg and Tc. In the antiferromagnetic phase (AF) (x=14), ρH increases more or less linearly with field and its temperature variation shows broad peaks around TN for lower fields.

  13. MnFe2O4@C Nanofibers as High-Performance Anode for Sodium-Ion Batteries.

    PubMed

    Liu, Yongchang; Zhang, Ning; Yu, Chuanming; Jiao, Lifang; Chen, Jun

    2016-05-11

    MnFe2O4 nanodots (∼3.3 nm) homogeneously dispersed in porous nitrogen-doped carbon nanofibers (denoted as MFO@C) were prepared by a feasible electrospinning technique. Meanwhile, MFO@C with the character of flexible free-standing membrane was directly used as binder- and current collector-free anode for sodium-ion batteries, exhibiting high electrochemical performance with high-rate capability (305 mA h g(-1) at 10000 mA g(-1) in comparison of 504 mA h g(-1) at 100 mA g(-1)) and ultralong cycling life (ca. 90% capacity retention after 4200 cycles). The Na-storage mechanism was systematically studied, revealing that MnFe2O4 is converted into metallic Mn and Fe after the first discharge (MnFe2O4 + 8Na(+) + 8e(-) → Mn + 2Fe + 4Na2O) and then to MnO and Fe2O3 during the following charge (Mn + 2Fe + 4Na2O → MnO + Fe2O3 + 8Na(+) + 8e(-)). The subsequent cycles occur through reversible redox reactions of MnO + Fe2O3 + 8Na(+) + 8e(-) ↔ Mn + 2Fe + 4Na2O, of which the reduction/oxidation of MnO/Mn takes place at a lower potential than that of Fe2O3/Fe. Furthermore, a soft package sodium-ion full battery with MFO@C anode and Na3V2(PO4)2F3/C cathode was assembled, delivering a stable capacity of ∼400 mA h g(-1) for MFO@C (with 100 cycles at 500 mA g(-1)) and a promising energy density of 77.8 Wh kg(-1) for the whole battery. This is owing to the distinctive structure of very-fine MnFe2O4 nanodots embedded in porous N-doped carbon nanofibers, which effectively improves the utilization rate of active materials, facilitates the transportation of electrons and Na(+) ions, and prevents the particle pulverization/agglomeration upon prolonged cycling.

  14. Elevated Temperature Deformation of Fe-39.8Al and Fe-15.6Mn-39.4Al

    NASA Technical Reports Server (NTRS)

    Whittenberger, J. Daniel

    2004-01-01

    The elevated temperature compressive properties of binary Fe-39.8 at % Al and Fe-15.6Mn-39.4Al have been measured between 1000 and 1300 K at strain rates between 10(exp 7) and 10(exp 3)/ s. Although the Mn addition to iron aluminide did not change the basic deformation characteristics, the Mn-modified alloy was slightly weaker. In the regime where deformation of FeAl occurs by a high stress exponent mechanism (n = 6), strength increases as the grain size decreases at least for diameters between approx. 200 and approx. 10 microns. Due to the limitation in the grain size-flow stress-temperature-strain rate database, the influence of further reductions of the grain size on strength is uncertain. Based on the appearance of subgrains in deformed iron aluminide, the comparison of grain diameters to expected subgrain sizes, and the grain size exponent and stress exponent calculated from deformation experiments, it is believed that grain size strengthening is the result of an artificial limitation on subgrain size as proposed by Sherby, Klundt and Miller.

  15. Magnetization and microstructure dynamics in Fe/MnAs/GaAs(001): Fe magnetization reversal by a femtosecond laser pulse.

    PubMed

    Spezzani, C; Ferrari, E; Allaria, E; Vidal, F; Ciavardini, A; Delaunay, R; Capotondi, F; Pedersoli, E; Coreno, M; Svetina, C; Raimondi, L; Zangrando, M; Ivanov, R; Nikolov, I; Demidovich, A; Danailov, M B; Popescu, H; Eddrief, M; De Ninno, G; Kiskinova, M; Sacchi, M

    2014-12-12

    Thin film magnetization reversal without applying external fields is an attractive perspective for applications in sensors and devices. One way to accomplish it is by fine-tuning the microstructure of a magnetic substrate via temperature control, as in the case of a thin Fe layer deposited on a MnAs/GaAs(001) template. This work reports a time-resolved resonant scattering study exploring the magnetic and structural properties of the Fe/MnAs system, using a 100 fs optical laser pulse to trigger local temperature variations and a 100 fs x-ray free-electron laser pulse to probe the induced magnetic and structural dynamics. The experiment provides direct evidence that a single optical laser pulse can reverse the Fe magnetization locally. It reveals that the time scale of the magnetization reversal is slower than that of the MnAs structural transformations triggered by the optical pulse, which take place after a few picoseconds already.

  16. Comparative Study on the Corrosion Resistance of Fe-Based Amorphous Metal, Borated Stainless Steel and Ni-Cr-Mo-Gd Alloy

    SciTech Connect

    Lian, Tiangan; Day, Daniel; Hailey, Phillip; Choi, Jor-Shan; Farmer, Joseph

    2007-07-01

    Iron-based amorphous alloy Fe{sub 49.7}Cr{sub 17.7}Mn{sub 1.9}Mo{sub 7.4}W{sub 1.6}B{sub 15.2}C{sub 3.8}Si{sub 2.4} was compared to borated stainless steel and Ni-Cr-Mo-Gd alloy on their corrosion resistance in various high-concentration chloride solutions. The melt-spun ribbon of this iron-based amorphous alloy have demonstrated a better corrosion resistance than the bulk borated stainless steel and the bulk Ni-Cr-Mo-Gd alloy, in high-concentration chloride brines at temperatures 90 deg. C or higher. (authors)

  17. Structural basis for assembly of the Mn(IV)/Fe(III) cofactor in the class Ic ribonucleotide reductase from Chlamydia trachomatis.

    PubMed

    Dassama, Laura M K; Krebs, Carsten; Bollinger, J Martin; Rosenzweig, Amy C; Boal, Amie K

    2013-09-17

    The class Ic ribonucleotide reductase (RNR) from Chlamydia trachomatis (Ct) employs a Mn(IV)/Fe(III) cofactor in each monomer of its β2 subunit to initiate nucleotide reduction. The cofactor forms by reaction of Mn(II)/Fe(II)-β2 with O2. Previously, in vitro cofactor assembly from apo β2 and divalent metal ions produced a mixture of two forms, with Mn at site 1 (Mn(IV)/Fe(III)) or site 2 (Fe(III)/Mn(IV)), of which the more active Mn(IV)/Fe(III) product predominates. Here we have addressed the basis for metal site selectivity by determining X-ray crystal structures of apo, Mn(II), and Mn(II)/Fe(II) complexes of Ct β2. A structure obtained anaerobically with equimolar Mn(II), Fe(II), and apoprotein reveals exclusive incorporation of Mn(II) at site 1 and Fe(II) at site 2, in contrast to the more modest site selectivity achieved previously. Site specificity is controlled thermodynamically by the apoprotein structure, as only minor adjustments of ligands occur upon metal binding. Additional structures imply that, by itself, Mn(II) binds in either site. Together, the structures are consistent with a model for in vitro cofactor assembly in which Fe(II) specificity for site 2 drives assembly of the appropriately configured heterobimetallic center, provided that Fe(II) is substoichiometric. This model suggests that use of a Mn(IV)/Fe(III) cofactor in vivo could be an adaptation to Fe(II) limitation. A 1.8 Å resolution model of the Mn(II)/Fe(II)-β2 complex reveals additional structural determinants for activation of the cofactor, including a proposed site for side-on (η(2)) addition of O2 to Fe(II) and a short (3.2 Å) Mn(II)-Fe(II) interionic distance, promoting formation of the Mn(IV)/Fe(IV) activation intermediate.

  18. Phosphorites, Co-rich Mn nodules, and Fe-Mn crusts from Galicia Bank, NE Atlantic: Reflections of Cenozoic tectonics and paleoceanography

    NASA Astrophysics Data System (ADS)

    González, Francisco Javier; Somoza, Luis; Hein, James R.; Medialdea, Teresa; León, Ricardo; Urgorri, Victoriano; Reyes, Jesús; Martín-Rubí, Juan Antonio

    2016-02-01

    A wide variety of marine mineral deposits were recovered from 750 to 1400 m water depths on Galicia Bank, Iberian margin. Mineral deposits include: (1) carbonate fluorapatite phosphorite slabs and nodules that replaced limestone and preserved original protolith fabric. (2) Ferromanganese vernadite crusts with high Mn and Fe (Mn/Fe = 1) contents, and thick stratabound layers consisting mainly of Mn (up to 27% MnO) and Fe (15% Fe2O3), which impregnated and replaced the phosphorite. (3) Co-rich Mn nodules are composed of romanechite and todorokite laminae. Mn-rich layers (up to 58% MnO) contain up to 1.8% Co. (4) Goethite nodules with Fe up to 67% Fe2O3 have low Mn and trace metals. We interpret this mineralization paragenesis to be related to major changes in oceanographic and tectonic regimes. Three phosphatization generations formed hardgrounds dated by 87Sr/86Sr isotopes as late Oligocene, early Miocene, and latest early Miocene. During the latest early Miocene, the hardground was fractured and breached due to regional intraplate tectonism, which was coeval with a widespread regional erosional unconformity. The stratabound layers and Co-rich manganese nodules were derived from low-temperature geothermally driven hydrothermal fluids, with fluid conduits along reactivated faults. During middle and late Miocene, the introduction of vigorous deep water flow from the Arctic generated growth of hydrogenetic ferromanganese crusts. Finally, growth of diagenetic Fe-rich nodules (late Pliocene) was promoted by the introduction of hypersaline Mediterranean Outflow Water into the Atlantic Ocean.

  19. Phase Field Modeling of Cyclic Austenite-Ferrite Transformations in Fe-C-Mn Alloys

    NASA Astrophysics Data System (ADS)

    Chen, Hao; Zhu, Benqiang; Militzer, Matthias

    2016-08-01

    Three different approaches for considering the effect of Mn on the austenite-ferrite interface migration in an Fe-0.1C-0.5Mn alloy have been coupled with a phase field model (PFM). In the first approach (PFM-I), only long-range C diffusion is considered while Mn is assumed to be immobile during the phase transformations. Both long-range C and Mn diffusions are considered in the second approach (PFM-II). In the third approach (PFM-III), long-range C diffusion is considered in combination with the Gibbs energy dissipation due to Mn diffusion inside the interface instead of solving for long-range diffusion of Mn. The three PFM approaches are first benchmarked with isothermal austenite-to-ferrite transformation at 1058.15 K (785 °C) before considering cyclic phase transformations. It is found that PFM-II can predict the stagnant stage and growth retardation experimentally observed during cycling transformations, whereas PFM-III can only replicate the stagnant stage but not the growth retardation and PFM-I predicts neither the stagnant stage nor the growth retardation. The results of this study suggest a significant role of Mn redistribution near the interface on reducing transformation rates, which should, therefore, be considered in future simulations of austenite-ferrite transformations in steels, particularly at temperatures in the intercritical range and above.

  20. Effects of biaxial strain on stability and half-metallicity of Cr and Mn pnictides and chalcogenides in the zinc-blende structure

    NASA Astrophysics Data System (ADS)

    Miao, M. S.; Lambrecht, Walter R. L.

    2005-08-01

    The effects of biaxial strain, imposed by epitaxial growth conditions, on the half-metallicity properties of Cr and Mn pnictides and chalcogenides were investigated using local spin-density-functional calculations. The minority band gaps were found to decrease significantly under the biaxial strain, whereas the spin-flip gaps changed only slightly. The calculations show that under epitaxial conditions for any choice of substrate, CrSe, MnAs, MnSe, and MnTe cannot be half metallic; CrAs and CrTe are barely half metallic as their SF gap is close to zero; and only CrSb and MnSb remain distinct half metals with spin-flip gaps of 0.9 and 0.3eV , respectively.

  1. The magneto-structural transition in Mn1-x Fe x CoGe

    NASA Astrophysics Data System (ADS)

    Ren, Q. Y.; Hutchison, W. D.; Wang, J. L.; Studer, A. J.; Din, M. F. Md; Muñoz Pérez, S.; Cadogan, J. M.; Campbell, S. J.

    2016-05-01

    Large refrigeration capacities, between 212(30) J kg-1 and 261(40) J kg-1 for a magnetic field change from 0 T to 5 T, were obtained in Mn1-x Fe x CoGe (x  =  0.01, 0.02, 0.03 and 0.04) compounds. A partial magnetic phase diagram has been derived on the basis of magnetic transition and martensitic transformation temperatures determined from differential scanning calorimetry (200 K to 450 K), variable temperature x-ray diffraction (20 K to 310 K) and magnetisation measurements (5 K to 340 K 0.01 T). Mn1-x Fe x CoGe compounds with compositions in the range x  =  0.01 to 0.03 exhibit magneto-structural transitions. Neutron diffraction experiments were carried out on the Mn0.98Fe0.02CoGe sample over the temperature range of 5 K to 450 K. The diffraction patterns were analysed based on irreducible representation theory which confirms a ferromagnetic structure in the sample with an atomic magnetic moment of 3.7(1)μ B at 5 K on the Mn sublattice, oriented along the orthorhombic c axis. More significantly, a magneto-structural transition around T M ~ 297(1) K with a full width at half maximum of 29 K is demonstrated directly via neutron diffraction. Larger magnetic entropy changes are obtained for the Mn1-x Fe x CoGe (x  =  0.01, 0.02 and 0.03) samples than for Mn0.96Fe0.04CoGe which has separate structural and magnetic transitions. In addition, it is noted that standard Arrott plots do not provide unambiguous insight to the nature of the magneto-structural transition in the Mn1-x Fe x CoGe compounds.

  2. Molecular controls on Cu and Zn isotopic fractionation in Fe-Mn crusts

    NASA Astrophysics Data System (ADS)

    Little, S. H.; Sherman, D. M.; Vance, D.; Hein, J. R.

    2014-06-01

    The isotopic systems of the transition metals are increasingly being developed as oceanic tracers, due to their tendency to be fractionated by biological and/or redox-related processes. However, for many of these promising isotope systems the molecular level controls on their isotopic fractionations are only just beginning to be explored. Here we investigate the relative roles of abiotic and biotic fractionation processes in controlling modern seawater Cu and Zn isotopic compositions. Scavenging to Fe-Mn oxides represents the principal output for Cu and Zn to sediments deposited under normal marine (oxic) conditions. Using Fe-Mn crusts as an analogue for these dispersed phases, we investigate the phase association and crystal chemistry of Cu and Zn in such sediments. We present the results of an EXAFS study that demonstrate unequivocally that Cu and Zn are predominantly associated with the birnessite (δ-MnO2) phase in Fe-Mn crusts, as previously predicted from sequential leaching experiments (e.g., Koschinsky and Hein, 2003). The crystal chemistry of Cu and Zn in the crusts implies a reduction in coordination number in the sorbed phase relative to the free metal ion in seawater. Thus, theory would predict equilibrium fractionations that enrich the heavy isotope in the sorbed phase (e.g., Schauble, 2004). In natural samples, Fe-Mn crusts and nodules are indeed isotopically heavy in Zn isotopes (at ∼1‰) compared to deep seawater (at ∼0.5‰), consistent with the predicted direction of equilibrium isotopic fractionation based on our observations of the coordination environment of sorbed Zn. Further, ∼50% of inorganic Zn‧ is chloro-complexed (the other ∼50% is present as the free Zn2+ ion), and complexation by Cl- is also predicted to favour equilibrium partitioning of light Zn isotopes into the dissolved phase. The heavy Zn isotopic composition of Fe-Mn crusts and nodules relative to seawater can therefore be explained by an inorganic fractionation during

  3. Tailoring Mg(x)Mn(1-x)Fe(2)O(4) superparamagnetic nanoferrites for magnetic fluid hyperthermia applications.

    PubMed

    Jeun, Minhong; Park, Sungwook; Jang, Gun Hyuk; Lee, Kwan Hyi

    2014-10-01

    A superparamagnetic nanoferrite (SPNF) with high magnetic moment, AC magnetically induced heating (AC-heating) capacity, and good biocompatibility is the most vital part of magnetic fluid hyperthermia for utilizing it in the clinics. Herein, we precisely tune magnetic properties and AC-heating characteristics of MgxMn1-xFe2O4 SPNF via chemically controlling the cations' concentration and distribution to develop a tailored MgxMn1-xFe2O4 SPNF as a potential magnetic fluid hyperthermia agent. The magnetic and AC-heating characteristics of the tailored MgxMn1-xFe2O4 SPNF are strongly dependent on the Mg/Mn cations' concentration and distribution, and Mg0.285Mn0.715Fe2O4 SPNF exhibits the highest saturation magnetization and AC-heating capacity as well as high biocompatibility.

  4. Enhanced Magnetism in Field-Cooled [Ni80Fe20/Mn]3 Multilayers Studied Using Polarized Neutron Reflectometry

    NASA Astrophysics Data System (ADS)

    Uilhoorn, W.; Callori, S. J.; Cortie, D. L.; Su, H.-C.; Khaydukov, Y.; Lin, K.-W.; Klose, F.

    2016-04-01

    Here, the interfacial magnetic coupling in an exchange biased [Ni80Fe20/Mn]3 multilayer system has been studied using polarized neutron reflectometry. Previous results on this system indicate the importance of the coupling between the Fe-Mn and Ni-Mn orbitals at the layer interfaces. Magnetic depth profiles of the multilayer were measured at low temperatures under field-cooled and zero-field-cooled conditions. While no definitive interfacial state was found, a magnetic moment enhancement of roughly 20-30% in the applied field direction was observed throughout the bulk of the NiFe layers in the field-cooled state as compared to the zero-field-cooled measurements. The origin of this enhancement also likely stems from Fe-Mn and Ni-Mn orbital coupling, but due to the interfacial roughnesses of the sample, the areas where this coupling plays an important role is no longer confined to the interface.

  5. Tailoring Mg(x)Mn(1-x)Fe(2)O(4) superparamagnetic nanoferrites for magnetic fluid hyperthermia applications.

    PubMed

    Jeun, Minhong; Park, Sungwook; Jang, Gun Hyuk; Lee, Kwan Hyi

    2014-10-01

    A superparamagnetic nanoferrite (SPNF) with high magnetic moment, AC magnetically induced heating (AC-heating) capacity, and good biocompatibility is the most vital part of magnetic fluid hyperthermia for utilizing it in the clinics. Herein, we precisely tune magnetic properties and AC-heating characteristics of MgxMn1-xFe2O4 SPNF via chemically controlling the cations' concentration and distribution to develop a tailored MgxMn1-xFe2O4 SPNF as a potential magnetic fluid hyperthermia agent. The magnetic and AC-heating characteristics of the tailored MgxMn1-xFe2O4 SPNF are strongly dependent on the Mg/Mn cations' concentration and distribution, and Mg0.285Mn0.715Fe2O4 SPNF exhibits the highest saturation magnetization and AC-heating capacity as well as high biocompatibility. PMID:25238143

  6. Texture evolution of cold rolled and reversion annealed metastable austenitic CrMnNi steels

    NASA Astrophysics Data System (ADS)

    Weidner, A.; Fischer, K.; Segel, C.; Schreiber, G.; Biermann, H.

    2015-04-01

    A thermo-mechanical process consisting of cold rolling and subsequent reversion annealing was applied to high-alloy metastable austenitic CrMnNi steels with different nickel contents. As a result of the reversion annealing ultrafine grained material with a grain size in the range between 500 nm up to 4 μm were obtained improving the strength behavior of the material. The evolution of the texture of both the cold rolled states and the reversion-annealed states was studied either by X-ray diffraction or by EBSD measurements. The nickel content has a significant influence on the austenite stability and consequently also on the amount of the martensitic phase transformation. However, the developed textures in both steel variants with different austenite stability revealed the same behavior. In both investigated steels the texture of the reverted austenite is a pronounced Bs-type texture as developed also for the deformed austenite

  7. PVD synthesis and high-throughput property characterization of NiFeCr alloy libraries

    SciTech Connect

    Rar, A.; Frafjord, J. J.; Fowlkes, Jason D.; Specht, E. D.; Rack, P. D.; Santella, M. L.; Bei, H.; George, E. P.; Pharr, G. M.

    2004-12-16

    Three methods of alloy library synthesis, thick-layer deposition followed by interdiffusion, composition-spread codeposition and electron-beam melting of thick deposited layers, have been applied to Ni-Fe-Cr ternary and Ni-Cr binary alloys. Structural XRD mapping and mechanical characterization by means of nanoindentation have been used to characterize the properties of the libraries. The library synthesis methods are compared from the point of view of the structural and mechanical information they can provide.

  8. High Curie temperature of Ce-Fe-Si compounds with ThMn12 structure

    SciTech Connect

    Zhou, C; Pinkerton, FE; Herbst, JF

    2015-01-15

    We report the discovery of ternary CeFe(12-x)Si(x)compounds possessing the ThMn12 structure. The samples were prepared by melt spinning followed by annealing. In contrast to other known Ce Fe-based binary and ternary compounds, CeFe12-xSix compounds exhibit exceptionally high Curie temperatures whose values increase with added Si substitution. The highest T. = 583 K in CeFe10Si2 rivals that of the well-established Nd2Fe14B compound. We ascribe the T-c behavior to a combination of Si-induced 3d band structure changes and partial Ce3+ stabilization. (C) 2014 Published by Elsevier Ltd.

  9. Effect of He+ irradiation on Fe-Cr alloys: Mössbauer-effect study

    NASA Astrophysics Data System (ADS)

    Dubiel, S. M.; Cieślak, J.; Reuther, H.

    2013-03-01

    Effect of He ions irradiation on three model Fe100-xCrx alloys (x = 5.8, 10.75 and 15.15) was investigated with the conversion electron Mössbauer spectroscopy. The study of the alloys irradiated with 25 keV ions revealed that the strongest effect occured in the Fe84.85Cr15.15 sample where an inversion of a short-range-order (SRO) parameter was found. Consequently, the investigation of the influence of the irradiation dose, D, was carried out on the chromium - most concentrated sample showing that the average hyperfine field, , the average angle between the normal to the sample's surface and the magnetization vector, <θ>, as well as the actual distribution of Fe/Cr atoms, as expressed by SRO parameters, strongly depend on D. In particular: (a) increases with D, and its maximum increase corresponds to a decrease of Cr content within the two-shell volume around the probe 57Fe nuclei by ˜2.3 at%, <⊝> decreases by ˜13° at maximum, (c) SRO-parameter averaged over the two-shell volume increases with D from weakly negative value (indicative of Cr atoms ordering) to weakly positive value (indicative of Cr atoms clustering). The inversion takes place at D ≈ 7 dpa.

  10. Elastic Modulus Measurement of ORNL ATF FeCrAl Alloys

    SciTech Connect

    Thompson, Zachary T.; Terrani, Kurt A.; Yamamoto, Yukinori

    2015-10-01

    Elastic modulus and Poisson’s ratio for a number of wrought FeCrAl alloys, intended for accident tolerant fuel cladding application, are determined via resonant ultrasonic spectroscopy. The results are reported as a function of temperature from room temperature to 850°C. The wrought alloys were in the fully annealed and unirradiated state. The elastic modulus for the wrought FeCrAl alloys is at least twice that of Zr-based alloys over the temperature range of this study. The Poisson’s ratio of the alloys was 0.28 on average and increased very slightly with increasing temperature.

  11. Neutron cross section covariances in the resonance region: 52Cr, 56Fe, 58Ni

    SciTech Connect

    Oblozinsky, P.; Cho, Y.-S.; Mattoon, C.M.; Mughabghab, S.F.

    2010-08-03

    We evaluated covariances for neutron capture and elastic scattering cross sections on major structural materials, {sup 52}Cr, {sup 56}Fe and {sup 58}Ni, in the resonance region which extends beyond 800 keV for each of them. Use was made of the recently developed covariance formalism based on kernel approximation along with data in the Atlas of Neutron Resonances. The data of most interest for AFCI applications, elastic scattering cross section uncertainties at energies above about few hundred keV, are on the level of about 12% for {sup 52}Cr, 7-8% for {sup 56}Fe and 5-6% for {sup 58}Ni.

  12. Development and quality assessments of commercial heat production of ATF FeCrAl tubes

    SciTech Connect

    Yamamoto, Yukinori

    2015-09-01

    Development and quality assessment of the 2nd generation ATF FeCrAl tube production with commercial manufacturers were conducted. The manufacturing partners include Sophisticated Alloys, Inc. (SAI), Butler, PA for FeCrAl alloy casting via vacuum induction melting, Oak Ridge National Laboratory (ORNL) for extrusion process to prepare the master bars/tubes to be tube-drawn, and Rhenium Alloys, Inc. (RAI), North Ridgeville, OH, for tube-drawing process. The masters bars have also been provided to Los Alamos National Laboratory (LANL) who works with Century Tubes, Inc., (CTI), San Diego, CA, as parallel tube production effort under the current program.

  13. The centralized control of elemental mercury emission from the flue gas by a magnetic rengenerable Fe-Ti-Mn spinel.

    PubMed

    Liao, Yong; Xiong, Shangchao; Dang, Hao; Xiao, Xin; Yang, Shijian; Wong, Po Keung

    2015-12-15

    A magnetic Fe-Ti-Mn spinel was developed to adsorb gaseous Hg(0) in our previous study. However, it is currently extremely restricted in the control of Hg(0) emission from the flue gas for at least three reasons: sorbent recovery, sorbent regeneration and the interference of the chemical composition in the flue gas. Therefore, the effect of SO2 and H2O on the adsorption of gaseous Hg(0) on the Fe-Ti-Mn spinel and the regeneration of spent Fe-Ti-Mn spinel were investigated in this study. Meanwhile, the procedure of the centralized control of Hg(0) emission from the flue gas by the magnetic Fe-Ti-Mn spinel has been analyzed for industrial application. The spent Fe-Ti-Mn spinel can be regenerated by water washing followed by the thermal treatment at 450 °C with no obvious decrease of its ability for Hg(0) capture. Meanwhile, gaseous Hg(0) in the flue gas can be remarkably concentrated during the regeneration, facilitating its safe disposal. Initial pilot test demonstrated that gaseous Hg(0) in the real flue gas can be concentrated at least 100 times by the Fe-Ti-Mn spinel. Therefore, Fe-Ti-Mn spinel was a novel magnetic regenerable sorbent, which can be used for the centralized control of Hg(0) emission from the flue gas.

  14. Fe-Mn bi-metallic oxides loaded on granular activated carbon to enhance dye removal by catalytic ozonation.

    PubMed

    Tang, Shoufeng; Yuan, Deling; Zhang, Qi; Liu, Yameng; Zhang, Qi; Liu, Zhengquan; Huang, Haiming

    2016-09-01

    A Fe-Mn bi-metallic oxide supported on granular activated carbon (Fe-Mn GAC) has been fabricated by an impregnation-desiccation method and tested in the catalytic ozonation of methyl orange (MO) degradation and mineralization. X-ray diffraction, scanning electron microscopy, and Fourier transform infrared spectroscopy characterizations revealed that Fe-Mn oxides were successfully loaded and uniformly distributed on the GAC, and nitrogen adsorption isotherms showed that the supported GAC retained a large surface area and a high pore volume compared with the pristine GAC. The catalytic activity was systematically assessed by monitoring the MO removal efficiencies at different operational parameters, such as catalyst dosage, initial solution pH, and ozone flow rate. The Fe-Mn GAC exhibited better catalytic activity relative to ozone alone and GAC alone, improving the TOC removal by 24.5 and 11.5 % and COD removal by 13.6 and 7.3 %, respectively. The reusability of the hybrid was examined over five consecutive cyclic treatments. The Fe-Mn GAC catalytic activity was only a slight loss in the cycles, showing good stability. The addition of Na2CO3 as hydroxyl radicals (•OH) scavengers proved that the catalytic ozonation mechanism was the enhanced generation of •OH by the Fe-Mn GAC. The above results render the Fe-Mn GAC an industrially promising candidate for catalytic ozonation of dye contaminant removal.

  15. Fe-Mn bi-metallic oxides loaded on granular activated carbon to enhance dye removal by catalytic ozonation.

    PubMed

    Tang, Shoufeng; Yuan, Deling; Zhang, Qi; Liu, Yameng; Zhang, Qi; Liu, Zhengquan; Huang, Haiming

    2016-09-01

    A Fe-Mn bi-metallic oxide supported on granular activated carbon (Fe-Mn GAC) has been fabricated by an impregnation-desiccation method and tested in the catalytic ozonation of methyl orange (MO) degradation and mineralization. X-ray diffraction, scanning electron microscopy, and Fourier transform infrared spectroscopy characterizations revealed that Fe-Mn oxides were successfully loaded and uniformly distributed on the GAC, and nitrogen adsorption isotherms showed that the supported GAC retained a large surface area and a high pore volume compared with the pristine GAC. The catalytic activity was systematically assessed by monitoring the MO removal efficiencies at different operational parameters, such as catalyst dosage, initial solution pH, and ozone flow rate. The Fe-Mn GAC exhibited better catalytic activity relative to ozone alone and GAC alone, improving the TOC removal by 24.5 and 11.5 % and COD removal by 13.6 and 7.3 %, respectively. The reusability of the hybrid was examined over five consecutive cyclic treatments. The Fe-Mn GAC catalytic activity was only a slight loss in the cycles, showing good stability. The addition of Na2CO3 as hydroxyl radicals (•OH) scavengers proved that the catalytic ozonation mechanism was the enhanced generation of •OH by the Fe-Mn GAC. The above results render the Fe-Mn GAC an industrially promising candidate for catalytic ozonation of dye contaminant removal. PMID:27316651

  16. High-pressure geochemistry of Cr, V and MN and implications for the origin of the moon

    NASA Astrophysics Data System (ADS)

    Ringwood, A. E.; Kato, T.; Hibberson, W.; Ware, N.

    1990-09-01

    Experimental studies of the partitioning of Cr, V, and Mn between molten iron and silicates show that these elements are lithophile at the pressures, temperatures, and oxygen fugacities prevailing in the earth's upper mantle and in the moon. Here, it is shown that at much higher pressures, corresponding to those in the earth's lower mantle, the partitioning behavior of Cr, V, and Mn changes owing to increasing solubility of oxygen in molten iron. Cr and V, and perhaps Mn, are preferentially partitioned into molten iron under these conditions. The depletion of these elements in the earth's mantle is therefore attributed to their siderophile behavior during formation of the earth's core, at pressures that were sufficiently high to cause substantial amounts of oxygen to dissolve in molten metallic iron. Similar depletion patterns of Cr, V, and Mn in the earth's mantle and the moon strongly suggest that a large proportion of the moon was derived from the earth's mantle after the earth's core had segregated.

  17. The Effect of Core-Mantle Differentiation on V, Cr, and Mn: Experimental Metal/Silicate Partitioning Results

    NASA Technical Reports Server (NTRS)

    Chabot, N. L.; Agee, C. B.

    2001-01-01

    The abundances of V, Cr, and Mn are similarly depleted in the Earth and Moon. We present metal/silicate partitioning results which examine if the depletions can be explained by a core formation event. Additional information is contained in the original extended abstract.

  18. Radiation tolerance of neutron-irradiated model Fe-Cr-Al alloys

    DOE PAGESBeta

    Field, Kevin G.; Hu, Xunxiang; Littrell, Kenneth C.; Yamamoto, Yukinori; Snead, Lance Lewis

    2015-07-14

    The Fe Cr Al alloy system has the potential to form an important class of enhanced accident-tolerant cladding materials in the nuclear power industry owing to the alloy system's higher oxidation resistance in high-temperature steam environments compared with traditional zirconium-based alloys. However, radiation tolerance of Fe Cr Al alloys has not been fully established. In this study, a series of Fe Cr Al alloys with 10 18 wt % Cr and 2.9 4.9 wt % Al were neutron irradiated at 382 C to 1.8 dpa to investigate the irradiation-induced microstructural and mechanical property evolution as a function of alloy composition.more » Dislocation loops with Burgers vector of a/2 111 and a 100 were detected and quantified. Results indicate precipitation of Cr-rich is primarily dependent on the bulk chromium composition. Mechanical testing of sub-size-irradiated tensile specimens indicates the hardening response seen after irradiation is dependent on the bulk chromium composition. Furthermore, a structure property relationship was developed; it indicated that the change in yield strength after irradiation is caused by the formation of these radiation-induced defects and is dominated by the large number density of Cr-rich α' precipitates at sufficiently high chromium contents after irradiation.« less

  19. Radiation tolerance of neutron-irradiated model Fe-Cr-Al alloys

    SciTech Connect

    Field, Kevin G.; Hu, Xunxiang; Littrell, Kenneth C.; Yamamoto, Yukinori; Snead, Lance Lewis

    2015-07-14

    The Fe Cr Al alloy system has the potential to form an important class of enhanced accident-tolerant cladding materials in the nuclear power industry owing to the alloy system's higher oxidation resistance in high-temperature steam environments compared with traditional zirconium-based alloys. However, radiation tolerance of Fe Cr Al alloys has not been fully established. In this study, a series of Fe Cr Al alloys with 10 18 wt % Cr and 2.9 4.9 wt % Al were neutron irradiated at 382 C to 1.8 dpa to investigate the irradiation-induced microstructural and mechanical property evolution as a function of alloy composition. Dislocation loops with Burgers vector of a/2 111 and a 100 were detected and quantified. Results indicate precipitation of Cr-rich is primarily dependent on the bulk chromium composition. Mechanical testing of sub-size-irradiated tensile specimens indicates the hardening response seen after irradiation is dependent on the bulk chromium composition. Furthermore, a structure property relationship was developed; it indicated that the change in yield strength after irradiation is caused by the formation of these radiation-induced defects and is dominated by the large number density of Cr-rich α' precipitates at sufficiently high chromium contents after irradiation.

  20. Radiation tolerance of neutron-irradiated model Fe-Cr-Al alloys

    NASA Astrophysics Data System (ADS)

    Field, Kevin G.; Hu, Xunxiang; Littrell, Kenneth C.; Yamamoto, Yukinori; Snead, Lance L.

    2015-10-01

    The Fe-Cr-Al alloy system has the potential to form an important class of enhanced accident-tolerant cladding materials in the nuclear power industry owing to the alloy system's higher oxidation resistance in high-temperature steam environments compared with traditional zirconium-based alloys. However, radiation tolerance of Fe-Cr-Al alloys has not been fully established. In this study, a series of Fe-Cr-Al alloys with 10-18 wt % Cr and 2.9-4.9 wt % Al were neutron irradiated at 382 °C to 1.8 dpa to investigate the irradiation-induced microstructural and mechanical property evolution as a function of alloy composition. Dislocation loops with Burgers vector of a/2<111> and a<100> were detected and quantified. Results indicate precipitation of Cr-rich α‧ is primarily dependent on the bulk chromium composition. Mechanical testing of sub-size-irradiated tensile specimens indicates the hardening response seen after irradiation is dependent on the bulk chromium composition. A structure-property relationship was developed; it indicated that the change in yield strength after irradiation is caused by the formation of these radiation-induced defects and is dominated by the large number density of Cr-rich α‧ precipitates at sufficiently high chromium contents after irradiation.