NASA Astrophysics Data System (ADS)
Calvo, Rafael; Sartoris, Rosana P.; Calvo, Hernán L.; Chagas, Edson F.; Rapp, Raul E.
2016-05-01
We study the spin chain behavior, a transition to 3D magnetic order and the magnitudes of the exchange interactions for the metal-amino acid complex Cu(D,L-alanine)2•H2O, a model compound to investigate exchange couplings supported by chemical paths characteristic of biomolecules. Thermal and magnetic data were obtained as a function of temperature (T) and magnetic field (B0). The magnetic contribution to the specific heat, measured between 0.48 and 30 K, displays above 1.8 K a 1D spin-chain behavior that can be fitted with an intrachain antiferromagnetic (AFM) exchange coupling constant 2J0=(-2.12±0.08) cm-1 (defined as ℋex(i,i+1) = -2J0SiṡSi+1), between neighbor coppers at 4.49 Å along chains connected by non-covalent and H-bonds. We also observe a narrow specific heat peak at 0.89 K indicating a phase transition to a 3D magnetically ordered phase. Magnetization curves at fixed T = 2, 4 and 7 K with B0 between 0 and 9 T, and at T between 2 and 300 K with several fixed values of B0 were globally fitted by an intrachain AFM exchange coupling constant 2J0=(-2.27±0.02) cm-1 and g = 2.091±0.005. Interchain interactions J1 between coppers in neighbor chains connected through long chemical paths with total length of 9.51 Å cannot be estimated from magnetization curves. However, observation of the phase transition in the specific heat data allows estimating the range 0.1≤|2J1|≤0.4 cm-1, covering the predictions of various approximations. We analyze the magnitudes of 2J0 and 2J1 in terms of the structure of the corresponding chemical paths. The main contribution in supporting the intrachain interaction is assigned to H-bonds while the interchain interactions are supported by paths containing H-bonds and carboxylate bridges, with the role of the H-bonds being predominant. We compare the obtained intrachain coupling with studies of compounds showing similar behavior and discuss the validity of the approximations allowing to calculate the interchain
Enhanced ordering temperatures in antiferromagnetic manganite superlattices
May, Stephen J.; Robertson, Lee; Ryan, P J; Kim, J.-W.; Santos, Tiffany S.; Karapetrova, Evgenia; Zarestky, Jerel L.; Zhai, X.; Te velthuis, Suzanne G.; Eckstein, James N.; Bader, S. D.; Bhattacharya, Anand
2009-01-01
The disorder inherent to doping by cation substitution in the complex oxides can have profound effects on collective ordered states. Here, we demonstrate that cation-site ordering achieved via digital synthesis techniques can dramatically enhance the antiferromagnetic ordering temperatures of manganite films. Cation-ordered (LaMnO3)m/(SrMnO3)2m superlattices exhibit N el temperatures (TN) that are the highest of any La1-xSrxMnO3 compound, ~70 K greater than compositionally equivalent randomly doped La1/3Sr2/3MnO3. The antiferromagnetic order is A-type, consisting of in-plane double-exchange-mediated ferromagnetic sheets coupled antiferromagnetically along the out-of-plane direction. Via synchrotron x-ray scattering, we have discovered an in-plane structural modulation that reduces the charge itinerancy and hence the ordering temperature within the ferromagnetic sheets, thereby limiting TN. This modulation is mitigated and driven to long wavelengths by cation ordering, enabling the higher TN values of the superlattices. These results provide insight into how cation-site ordering can enhance cooperative behavior in oxides through subtle structural phenomena.
Enhanced ordering temperatures in antiferromagnetic manganite superlattices.
May, S. J.; Ryan, P. J.; Robertson, J. L.; Kim, J.-W.; Santos, T. S.; Karapetrova, E.; Zaresty, J. L.; Zhai, X.; te Velthuis, S. G. E.; Eckstein, J. N.; Bader, S. D.; Bhattacharya, A.; Iowa State Univ.; ORNL; Univ. of Illinois
2009-01-01
The disorder inherent to doping by cation substitution in the complex oxides can have profound effects on collective-ordered states. Here, we demonstrate that cation-site ordering achieved through digital-synthesis techniques can dramatically enhance the antiferromagnetic ordering temperatures of manganite films. Cation-ordered (LaMnO{sub 3}){sub m}/(SrMnO{sub 3}){sub 2m} superlattices show Neel temperatures (TN) that are the highest of any La{sub 1-x}Sr{sub x}MnO{sub 3} compound, {approx}70 K greater than compositionally equivalent randomly doped La{sub 1/3}Sr{sub 2/3}MnO{sub 3}. The antiferromagnetic order is A-type, consisting of in-plane double-exchange-mediated ferromagnetic sheets coupled antiferromagnetically along the out-of-plane direction. Through synchrotron X-ray scattering, we have discovered an in-plane structural modulation that reduces the charge itinerancy and hence the ordering temperature within the ferromagnetic sheets, thereby limiting TN. This modulation is mitigated and driven to long wavelengths by cation ordering, enabling the higher TN values of the superlattices. These results provide insight into how cation-site ordering can enhance cooperative behavior in oxides through subtle structural phenomena.
Order and topology in antiferromagnets with surfaces
NASA Astrophysics Data System (ADS)
Charilaou, Michalis; Hellman, Frances
2014-03-01
We show using Monte Carlo simulations and mean-field theory that the antiferromagnetic (AFM) magnetization, arising from uncompensated spins, exhibits a unique thermodynamic behavior that differs from that of ferromagnets or of the Néel vector. More importantly, the net uncompensated magnetization is lower than that of the surface due to finite size effects. This phenomenon can be is manifested in thin films but it is in fact the same even in infinite systems with free surfaces, suggesting a topological order in uncompensated antiferromagnets. Moreover, we investigate the effects of defects and roughness on the magnetization of AFM and show that with increasing roughness the magnetization decreases non-monotonically and reaches values of only a few percent. Thanks to DOE BES LBNL magnetism program and Swiss Federation for support.
Antiferromagnetic ordering in MnF(salen)
NASA Astrophysics Data System (ADS)
Čižmár, Erik; Risset, Olivia N.; Wang, Tong; Botko, Martin; Ahir, Akhil R.; Andrus, Matthew J.; Park, Ju-Hyun; Abboud, Khalil A.; Talham, Daniel R.; Meisel, Mark W.; Brown, Stuart E.
2016-06-01
Antiferromagnetic order at {{T}\\text{N}}=23 K has been identified in Mn(III)F(salen), salen = H14C16N2O2, an S = 2 linear-chain system. Using single crystals, specific heat studies performed in magnetic fields up to 9 T revealed the presence of a field-independent cusp at the same temperature where 1H NMR studies conducted at 42 MHz observed dramatic changes in the spin-lattice relaxation time, T 1, and in the linewidths. Low-field (less than 0.1 T) magnetic susceptibility studies of single crystals and randomly-arranged microcrystalline samples reveal subtle features associated with the transition.
Antiferromagnetic ordering in MnF(salen).
Čižmár, Erik; Risset, Olivia N; Wang, Tong; Botko, Martin; Ahir, Akhil R; Andrus, Matthew J; Park, Ju-Hyun; Abboud, Khalil A; Talham, Daniel R; Meisel, Mark W; Brown, Stuart E
2016-06-15
Antiferromagnetic order at [Formula: see text] K has been identified in Mn(III)F(salen), salen = H14C16N2O2, an S = 2 linear-chain system. Using single crystals, specific heat studies performed in magnetic fields up to 9 T revealed the presence of a field-independent cusp at the same temperature where (1)H NMR studies conducted at 42 MHz observed dramatic changes in the spin-lattice relaxation time, T 1, and in the linewidths. Low-field (less than 0.1 T) magnetic susceptibility studies of single crystals and randomly-arranged microcrystalline samples reveal subtle features associated with the transition. PMID:27160792
Higher Order Lagrange Finite Elements In M3D
J. Chen; H.R. Strauss; S.C. Jardin; W. Park; L.E. Sugiyama; G. Fu; J. Breslau
2004-12-17
The M3D code has been using linear finite elements to represent multilevel MHD on 2-D poloidal planes. Triangular higher order elements, up to third order, are constructed here in order to provide M3D the capability to solve highly anisotropic transport problems. It is found that higher order elements are essential to resolve the thin transition layer characteristic of the anisotropic transport equation, particularly when the strong anisotropic direction is not aligned with one of the Cartesian coordinates. The transition layer is measured by the profile width, which is zero for infinite anisotropy. It is shown that only higher order schemes have the ability to make this layer converge towards zero when the anisotropy gets stronger and stronger. Two cases are considered. One has the strong transport direction partially aligned with one of the element edges, the other doesn't have any alignment. Both cases have the strong transport direction misaligned with the grid line by some angles.
Culturing Cells in 3D Ordered Cellular Solids
NASA Astrophysics Data System (ADS)
Lin, Keng-Hui; Lin, Wang-Jung; Lin, Jing-Ying
2011-03-01
Constructing a well-defined 3D microenvironment for cell growth is a key step for tissue engineering and mechanobiology. We demonstrate high-throughput fabrication of gelatin-based ordered cellular solids with tunable pore size and solid fraction. This process involves generating monodisperse liquid foam with a cross-flow microfluidic device. The monodisperse liquid foam was further processed into open-cell solid foam, which was used as scaffolds for 3D cell culture. Three distinct cell types were cultured under these conditions and displayed appropriate physiological, morphological, and functional characteristics. Epithelial cells formed cyst-like structures and were polarized inside pores, myoblasts adopted a tubular structure and fused into myotubes, and fibroblasts exhibited wide varieties of morphologies depending on their location inside the scaffolds. These ordered cellular solids therefore make possible the study of pore-size effects on cells.
Magnetic ordering in digital alloys of group-IV semiconductors with 3d-transition metals
Otrokov, M. M.; Tugushev, V. V.; Ernst, A.; Ostanin, S. A.; Kuznetsov, V. M.; Chulkov, E. V.
2011-04-15
The ab initio investigation of the magnetic ordering in digital alloys consisting of monolayers of 3d-transition metals Ti, V, Cr, Mn, Fe, Co, and Ni introduced into the Si, Ge, and Si{sub 0.5}Ge{sub 0.5} semiconductor hosts is reported. The calculations of the parameters of the exchange interactions and total-energy calculations indicate that the ferromagnetic order appears only in the manganese monolayers, whereas the antiferromagnetic order is more probable in V, Cr, and Fe monolayers, and Ti, Co, and Ni monolayers are nonmagnetic. The stability of the ferromagnetic phase in digital alloys containing manganese monolayers has been analyzed using the calculations of magnon spectra.
Competing Orders in a Nearly Antiferromagnetic Metal.
Schattner, Yoni; Gerlach, Max H; Trebst, Simon; Berg, Erez
2016-08-26
We study the onset of spin-density wave order in itinerant electron systems via a two-dimensional lattice model amenable to numerically exact, sign-problem-free determinantal quantum Monte Carlo simulations. The finite-temperature phase diagram of the model reveals a dome-shaped d-wave superconducting phase near the magnetic quantum phase transition. Above the critical superconducting temperature, an extended fluctuation regime manifests itself in the opening of a gap in the electronic density of states and an enhanced diamagnetic response. While charge density wave fluctuations are moderately enhanced in the proximity of the magnetic quantum phase transition, they remain short ranged. The striking similarity of our results to the phenomenology of many unconventional superconductors points a way to a microscopic understanding of such strongly coupled systems in a controlled manner. PMID:27610877
Superconductivity in the vicinity of antiferromagnetic order in CrAs and related materials
NASA Astrophysics Data System (ADS)
Luo, Jianlin
2015-03-01
Transition-metal oxides or pnictides are in rich of novel and intriguing electronic behaviors due to multiple quantum orders and competing phenomena. Among the different electronic states, the emergence of superconductivity in the vicinity of other quantum orders is at the heart of the rich physics. Superconductivity has been observed in a majority of 3d transition-metal compounds except for the Cr- and Mn- based compounds. It is thus of high interest in exploring possible superconductivity in those systems. In this talk, I will present the discovery of superconductivity on the verge of antiferromagnetic order in CrAs via the application of external high pressure. Bulk superconductivity with Tc ~ 2 K emerges at the critical pressure Pc ~ 8 kbar, where the first-order antiferromagnetic transition at TN ~ 265 K under ambient pressure is completely suppressed. In addition, quantum criticality and non-Fermi liquid behavior are observed near Pc, which we interpret as originating from a nearly second-order magnetic quantum phase transition that is concomitant with a first-order structural transition. The present finding opens a new avenue for searching novel superconductors in the Cr and other 3d transitional-metal based systems. In collaboration with Wei Wu, Jinguang Cheng, Kazuyuki Matsubayashi, Panpan Kong, Fukun Lin, Changqing Jin, Nanlin Wang, Yoshiya Uwatoko, Rong Yi, and Qimiao Si.
Topological order in an exactly solvable 3D spin model
Bravyi, Sergey; Leemhuis, Bernhard; Terhal, Barbara M.
2011-04-15
Research highlights: RHtriangle We study exactly solvable spin model with six-qubit nearest neighbor interactions on a 3D face centered cubic lattice. RHtriangle The ground space of the model exhibits topological quantum order. RHtriangle Elementary excitations can be geometrically described as the corners of rectangular-shaped membranes. RHtriangle The ground space can encode 4g qubits where g is the greatest common divisor of the lattice dimensions. RHtriangle Logical operators acting on the encoded qubits are described in terms of closed strings and closed membranes. - Abstract: We study a 3D generalization of the toric code model introduced recently by Chamon. This is an exactly solvable spin model with six-qubit nearest-neighbor interactions on an FCC lattice whose ground space exhibits topological quantum order. The elementary excitations of this model which we call monopoles can be geometrically described as the corners of rectangular-shaped membranes. We prove that the creation of an isolated monopole separated from other monopoles by a distance R requires an operator acting on {Omega}(R{sup 2}) qubits. Composite particles that consist of two monopoles (dipoles) and four monopoles (quadrupoles) can be described as end-points of strings. The peculiar feature of the model is that dipole-type strings are rigid, that is, such strings must be aligned with face-diagonals of the lattice. For periodic boundary conditions the ground space can encode 4g qubits where g is the greatest common divisor of the lattice dimensions. We describe a complete set of logical operators acting on the encoded qubits in terms of closed strings and closed membranes.
NASA Astrophysics Data System (ADS)
Kundu, Asish K.; Hardy, Vincent; Caignaert, Vincent; Raveau, Bernard
2015-12-01
A new family of oxides in which 3d-3d and 3d-4f interactions are of comparable strength has been synthesized and characterized both from structural and physical viewpoints. These compounds of formulation Ba2LnFeO5 (Ln = Sm, Eu, Gd, Dy, Ho, Er, Yb) are isotypic to the perovskite derivative Ba2YFeO5. They exhibit an original structure consisting of isolated FeO4 tetrahedra linked via LnO6 (or YO6) octahedra. Magnetic and calorimetric measurements show that all these compounds exhibit a unique, antiferromagnetic transition involving both the 3d and 4f ions. The antiferromagnetic properties of the Ln = Y phase (non-magnetic Y3+) and of the Ln = Eu (non-magnetic ground state multiplet of Eu3+) are ascribed to super-super exchange Fe-O-O-Fe interactions, leading to the lowest T N (5.5 K for Y and 4.6 K for Eu). The introduction of a magnetic lanthanide, i.e. Ln = Sm, Gd, Dy, Ho, Er, Yb, in the octahedral sites, leads to larger T N values (up to 9.8 K for Ln = Yb). It is found that several mechanisms must be taken into account to explain the complex evolution of the magnetic properties along the Ba2LnFeO5 series. In particular, the super-exchange Ln-O-Fe, as well as the on-site Ln3+ magnetocrystalline anisotropy, are suggested to play crucial roles. This Ba2LnFeO5 series offers a rare opportunity to investigate experimentally a situation where the 3d-3d and 3d-4f interactions co-operate on an equal footing to trigger a unique long-range magnetic ordering in insulating oxides.
Antiferromagnetic order in MnO spherical nanoparticles
Wang, Cuihuan; Baker, Sheila N; Lumsden, Mark D; Nagler, Stephen E; Heller, William T; Baker, Gary A; Deen, P P; Cranswick, Lachlan M.D.; Su, Y.; Christianson, Andrew D
2011-01-01
We have performed unpolarized and polarized neutron diffraction experiments on monodisperse 8- and 13-nm antiferromagnetic MnO nanoparticles. For the 8-nm sample, the antiferromagnetic transition temperature T{sub N} (114 K) is suppressed compared to that in the bulk material (119 K), while for the 13-nm sample T{sub N} (120 K) is comparable to that in the bulk. The neutron diffraction data of the nanoparticles is well described using the bulk MnO magnetic structure but with a substantially reduced average magnetic moment of 4.2 {+-} 0.3 {micro}{sub B}/Mn for the 8-nm sample and 3.9 {+-} 0.2 {micro}{sub B}/Mn for the 13-nm sample. An analysis of the polarized neutron data on both samples shows that in an individual MnO nanoparticle about 80% of Mn ions order. These results can be explained by a structure in which the monodisperse nanoparticles studied here have a core that behaves similar to the bulk with a surface layer which does not contribute significantly to the magnetic order.
Magnetic ordering in frustrated antiferromagnets on the pyrochlore lattice
NASA Astrophysics Data System (ADS)
Chern, Gia-Wei
Pyrochlore antiferromagnet is one of the most studied examples of strongly-interacting systems. The conflict between the lattice geometry and the local spin correlations favored by their interactions precludes the simple Neel ordering and creates an extensive degeneracy of the classical ground state. This, in turn, renders the magnet susceptible to nominally small perturbations such as quantum fluctuations, anisotropies, and dipolar interactions. Of particular interest is the classical Heisenberg spins on the pyrochlore lattice with exchange interactions restricted to the nearest neighbors. It has been demonstrated by analytical arguments and numerical simulations that the spin system remains disordered down to the lowest temperatures. In this thesis I study how magnetic ordering is induced by residual perturbations in such a system. Apart from the theoretical interest, the work presented in this thesis is mainly motivated by experimental observations of real materials. Three mechanisms of breaking the ground-state degeneracy are considered here: (1) order by distortion, (2) further-neighbor exchange interactions, and (3) the orbital degrees of freedom. In the first part, we present a theoretical model describing the lattice distortion and incommensurate magnetic order in the compound CdCr2O 4, which belongs to a class of chromium spinels exhibiting the magnetoelastic phase transitions. The magnetic frustration is relieved through the spin-driven Jahn-Teller effect involving a phonon doublet with odd parity. The distortion stabilizes a collinear magnetic order with the propagation wavevector q = 2pi(0, 0, 1). The crystal structure becomes chiral due to the lack of inversion symmetry. The handedness is transferred to the magnetic system by the relativistic spin-orbit coupling: the collinear state is twisted into a long spiral with the spins in the ac plane and q shifted to 2pi(0, delta, 1), consistent with the experiments. In the second part, we examine the effects
Kinetically inhibited order in a diamond-lattice antiferromagnet.
MacDougall, Gregory J; Gout, Delphine; Zarestky, Jerel L; Ehlers, Georg; Podlesnyak, Andrey; McGuire, Michael A; Mandrus, David; Nagler, Stephen E
2011-09-20
Frustrated magnetic systems exhibit highly degenerate ground states and strong fluctuations, often leading to new physics. An intriguing example of current interest is the antiferromagnet on a diamond lattice, realized physically in A-site spinel materials. This is a prototypical system in three dimensions where frustration arises from competing interactions rather than purely geometric constraints, and theory suggests the possibility of unusual magnetic order at low temperature. Here, we present a comprehensive single-crystal neutron scattering study of CoAl(2)O(4), a highly frustrated A-site spinel. We observe strong diffuse scattering that peaks at wavevectors associated with Néel ordering. Below the temperature T(∗) = 6.5 K, there is a dramatic change in the elastic scattering lineshape accompanied by the emergence of well-defined spin-wave excitations. T(∗) had previously been associated with the onset of glassy behavior. Our new results suggest instead that T(∗) signifies a first-order phase transition, but with true long-range order inhibited by the kinetic freezing of domain walls. This scenario might be expected to occur widely in frustrated systems containing first-order phase transitions and is a natural explanation for existing reports of anomalous glassy behavior in other materials. PMID:21896723
Kinetically Inhibited Order in a Diamond-Lattice Antiferromagnet
MacDougall, Gregory J; Gout, Delphine J; Zarestky, Jerel L; Ehlers, Georg; Podlesnyak, Andrey A; McGuire, Michael A; Mandrus, David; Nagler, Stephen E
2011-01-01
Frustrated magnetic systems exhibit highly degenerate ground states and strong fluctuations, often leading to new physics. An intriguing example of current interest is the antiferromagnet on a diamond lattice, realized physically in the A-site spinel materials. This is a prototypical system in three dimensions where frustration arises from competing interactions rather than purely geometric constraints, and theory suggests the possibility of novel order at low temperature. Here we present a comprehensive single crystal neutron scattering study CoAl2O4, a highly frustrated A-site spinel. We observe strong diffuse scattering that peaks at wavevectors associated with Neel ordering. Below the temperature T*=6.5K, there is a dramatic change in elastic scattering lineshape accompanied by the emergence of well-defined spin-wave excitations. T* had previously been associated with the onset of glassy behavior. Our new results suggest instead that in fact T* signifies a first-order phase transition, but with true long-range order inhibited by the kinetic freezing of domain walls. This scenario might be expected to occur widely in frustrated systems containing first-order phase transitions and is a natural explanation for existing reports of anomalous glassy behavior in other materials.
Kinetically inhibited order in a diamond-lattice antiferromagnet
MacDougall, Gregory J.; Gout, Delphine; Zarestky, Jerel L.; Ehlers, Georg; Podlesnyak, Andrey; McGuire, Michael A.; Mandrus, David; Nagler, Stephen E.
2011-01-01
Frustrated magnetic systems exhibit highly degenerate ground states and strong fluctuations, often leading to new physics. An intriguing example of current interest is the antiferromagnet on a diamond lattice, realized physically in A-site spinel materials. This is a prototypical system in three dimensions where frustration arises from competing interactions rather than purely geometric constraints, and theory suggests the possibility of unusual magnetic order at low temperature. Here, we present a comprehensive single-crystal neutron scattering study of CoAl2O4, a highly frustrated A-site spinel. We observe strong diffuse scattering that peaks at wavevectors associated with Néel ordering. Below the temperature T∗ = 6.5 K, there is a dramatic change in the elastic scattering lineshape accompanied by the emergence of well-defined spin-wave excitations. T∗ had previously been associated with the onset of glassy behavior. Our new results suggest instead that T∗ signifies a first-order phase transition, but with true long-range order inhibited by the kinetic freezing of domain walls. This scenario might be expected to occur widely in frustrated systems containing first-order phase transitions and is a natural explanation for existing reports of anomalous glassy behavior in other materials. PMID:21896723
Ferromagnetic and antiferromagnetic order in bacterial vortex lattices
NASA Astrophysics Data System (ADS)
Wioland, Hugo; Woodhouse, Francis G.; Dunkel, Jörn; Goldstein, Raymond E.
2016-04-01
Despite their inherently non-equilibrium nature, living systems can self-organize in highly ordered collective states that share striking similarities with the thermodynamic equilibrium phases of conventional condensed-matter and fluid systems. Examples range from the liquid-crystal-like arrangements of bacterial colonies, microbial suspensions and tissues to the coherent macro-scale dynamics in schools of fish and flocks of birds. Yet, the generic mathematical principles that govern the emergence of structure in such artificial and biological systems are elusive. It is not clear when, or even whether, well-established theoretical concepts describing universal thermostatistics of equilibrium systems can capture and classify ordered states of living matter. Here, we connect these two previously disparate regimes: through microfluidic experiments and mathematical modelling, we demonstrate that lattices of hydrodynamically coupled bacterial vortices can spontaneously organize into distinct patterns characterized by ferro- and antiferromagnetic order. The coupling between adjacent vortices can be controlled by tuning the inter-cavity gap widths. The emergence of opposing order regimes is tightly linked to the existence of geometry-induced edge currents, reminiscent of those in quantum systems. Our experimental observations can be rationalized in terms of a generic lattice field theory, suggesting that bacterial spin networks belong to the same universality class as a wide range of equilibrium systems.
Order by virtual crystal field fluctuations in pyrochlore XY antiferromagnets
NASA Astrophysics Data System (ADS)
Rau, Jeffrey G.; Petit, Sylvain; Gingras, Michel J. P.
2016-05-01
Conclusive evidence of order by disorder is scarce in real materials. Perhaps one of the strongest cases presented has been for the pyrochlore XY antiferromagnet Er2Ti2O7 , with the ground state selection proceeding by order by disorder induced through the effects of quantum fluctuations. This identification assumes the smallness of the effect of virtual crystal field fluctuations that could provide an alternative route to picking the ground state. Here we show that this order by virtual crystal field fluctuations is not only significant, but competitive with the effects of quantum fluctuations. Further, we argue that higher-multipolar interactions that are generically present in rare-earth magnets can dramatically enhance this effect. From a simplified bilinear-biquadratic model of these multipolar interactions, we show how the virtual crystal field fluctuations manifest in Er2Ti2O7 using a combination of strong-coupling perturbation theory and the random-phase approximation. We find that the experimentally observed ψ2 state is indeed selected and the experimentally measured excitation gap can be reproduced when the bilinear and biquadratic couplings are comparable while maintaining agreement with the entire experimental spin-wave excitation spectrum. Finally, we comment on possible tests of this scenario and discuss implications for other order-by-disorder candidates in rare-earth magnets.
Quantum order by disorder in frustrated diamond lattice antiferromagnets.
Bernier, Jean-Sébastien; Lawler, Michael J; Kim, Yong Baek
2008-07-25
We present a quantum theory of frustrated diamond lattice antiferromagnets. Considering quantum fluctuations as the predominant mechanism relieving spin frustration, we find a rich phase diagram comprising of six phases with coplanar spiral ordering in addition to the Néel phase. By computing the specific heat of these ordered phases, we obtain a remarkable agreement between (k, k, 0) spiral ordering and the experimental specific heat data for the diamond lattice spinel compounds MnSc2S4, Co3O4, and CoRh2O4, i.e., specific heat data is a strong evidence for (k, k, 0) spiral ordering in all of these materials. This prediction can be tested in future neutron scattering experiments on Co3O4 and CoRh2O4, and is consistent with existing neutron scattering data on MnSc2S4. Based on this agreement, we infer a monotonically increasing relationship between frustration and the strength of quantum fluctuations. PMID:18764361
Ferromagnetic and antiferromagnetic order in bacterial vortex lattices
Wioland, Hugo; Woodhouse, Francis G.; Dunkel, Jörn; Goldstein, Raymond E.
2016-01-01
Despite their inherent non-equilibrium nature1, living systems can self-organize in highly ordered collective states2,3 that share striking similarities with the thermodynamic equilibrium phases4,5 of conventional condensed matter and fluid systems. Examples range from the liquid-crystal-like arrangements of bacterial colonies6,7, microbial suspensions8,9 and tissues10 to the coherent macro-scale dynamics in schools of fish11 and flocks of birds12. Yet, the generic mathematical principles that govern the emergence of structure in such artificial13 and biological6–9,14 systems are elusive. It is not clear when, or even whether, well-established theoretical concepts describing universal thermostatistics of equilibrium systems can capture and classify ordered states of living matter. Here, we connect these two previously disparate regimes: Through microfluidic experiments and mathematical modelling, we demonstrate that lattices of hydrodynamically coupled bacterial vortices can spontaneously organize into distinct phases of ferro- and antiferromagnetic order. The preferred phase can be controlled by tuning the vortex coupling through changes of the inter-cavity gap widths. The emergence of opposing order regimes is tightly linked to the existence of geometry-induced edge currents15,16, reminiscent of those in quantum systems17–19. Our experimental observations can be rationalized in terms of a generic lattice field theory, suggesting that bacterial spin networks belong to the same universality class as a wide range of equilibrium systems. PMID:27213004
Antiferromagnetic Ordering of Mn(III)F(salen)
NASA Astrophysics Data System (ADS)
Meisel, M. W.; Wang, Tong; Brown, S. E.; Botko, M.; Čižmár, E.; Risset, O. N.; Talham, D. R.
2014-03-01
Due to a report suggesting Mn(III)F(salen), salen = H14C16N2O2, is an S = 2 Haldane system with J /kB = 50 K and no long-range order down to 2 K based on standard magnetometry studies,[2] specific heat and NMR measurements were performed. Using small single crystals, specific heat studies revealed the presence of an anomaly near 23 K, and this response was robust in fields up to 9 T. The 1H NMR results performed on a single crystal in 1 T revealed a sharp transition characteristic of antiferromagnetic ordering at 22.5 K. Measuring the magnetic response of the same single crystal in a commercial magnetometer reveals the presence of a subtle feature, near 23 K, that is not resolved with as-grown, randomlly oriented microcrystalline samples. These findings provide insight into the results obtained in torque magnetometry, EPR, and neutron scattering data.[3] Supported by NSF via DMR-1202033 (MWM), DMR-1105531 (SEB), DMR-1005581 (DRT), and DMR-1157490 (NHMFL), by the Slovak Agency for Research and Development via APVV-0132-11 (EČ), and by the Fulbright Commission of the Slovak Republic (MWM).
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... COMMISSION Makism3D Corp.; Order of Suspension of Trading December 13, 2013. It appears to the Securities and... trading in the securities of Makism3D Corp. (``Makism3D'') because of concerns regarding the accuracy and... protection of investors require a suspension of trading in the securities of the above-listed...
NASA Astrophysics Data System (ADS)
Shahjahan, M.; Oguchi, T.
2016-06-01
Electronic structures and magnetic properties of group I-III-VI2 chalcopyrite-type compounds Cu(Al 1 - 2 xAxBx)Se2 are calculated using the Korringa-Kohn-Rostoker Green's function method, where A (Ti, V, Cr, Mn) and B (Fe, Co, Ni) are 3d transition metal atoms, and x is atomic concentration. We found that codoping of Cr-Co and V-Ni pairs at Al site of host CuAlSe2 exhibit antiferromagnetic (AF) half metallicity with low Curie temperature (TC). The AF half metallic property is supported by nullified net magnetic moment and compensated density of states in the minority spin direction. On the other hand, codoping of Cr-Ni, Mn-Co, V-Co, and Ti-Co pairs at Al site of host CuAlSe2 manifest ferrimagnetic half metallicity with a small net magnetization and keeping antiparallel local spin moments. In Mn-Co case TC is close to room temperature. Besides, Cr-Fe, V-Fe, and Ti-Ni codoping cases lead to an instable magnetic ordering and therefore obtain a disordered local moment (spin-glass like) state.
Long-range order for the spin-1 Heisenberg model with a small antiferromagnetic interaction
Lees, Benjamin
2014-09-15
We look at the general SU(2) invariant spin-1 Heisenberg model. This family includes the well-known Heisenberg ferromagnet and antiferromagnet as well as the interesting nematic (biquadratic) and the largely mysterious staggered-nematic interaction. Long range order is proved using the method of reflection positivity and infrared bounds on a purely nematic interaction. This is achieved through the use of a type of matrix representation of the interaction making clear several identities that would not otherwise be noticed. Using the reflection positivity of the antiferromagnetic interaction one can then show that the result is maintained if we also include an antiferromagnetic interaction that is sufficiently small.
Detection of antiferromagnetic order by cooling atoms in an optical lattice
NASA Astrophysics Data System (ADS)
Yang, Tsung-Lin; Teles, Rafael; Hazzard, Kaden; Hulet, Randall; Rice University Collaboration
2016-05-01
We have realized the Fermi-Hubbard model with fermionic 6 Li atoms in a three-dimensional compensated optical lattice. The compensated optical lattice has provided low enough temperatures to produce short-range antiferromagnetic (AF) spin correlations, which we detect via Bragg scattering of light. Previously, we reached temperatures down to 1.4 times that of the AFM phase transition, more than a factor of 2 below temperatures obtained previously in 3D optical lattices with fermions. In order to further reduce the entropy in the compensated lattice, we implement an entropy conduit - which is a single blue detuned laser beam with a waist size smaller than the overall atomic sample size. This repulsive narrow potential provides a conductive metallic path between the low entropy core and the edges of the atomic sample where atoms may be evaporated. In addition, the entropy conduit may store entropy, thus further lowering the entropy in the core. We will report on the status of these efforts to further cool atoms in the optical lattice. Work supported by ARO MURI Grant, NSF and The Welch Foundation.
NASA Astrophysics Data System (ADS)
Jungwirth, T.; Marti, X.; Wadley, P.; Wunderlich, J.
2016-03-01
Antiferromagnetic materials are internally magnetic, but the direction of their ordered microscopic moments alternates between individual atomic sites. The resulting zero net magnetic moment makes magnetism in antiferromagnets externally invisible. This implies that information stored in antiferromagnetic moments would be invisible to common magnetic probes, insensitive to disturbing magnetic fields, and the antiferromagnetic element would not magnetically affect its neighbours, regardless of how densely the elements are arranged in the device. The intrinsic high frequencies of antiferromagnetic dynamics represent another property that makes antiferromagnets distinct from ferromagnets. Among the outstanding questions is how to manipulate and detect the magnetic state of an antiferromagnet efficiently. In this Review we focus on recent works that have addressed this question. The field of antiferromagnetic spintronics can also be viewed from the general perspectives of spin transport, magnetic textures and dynamics, and materials research. We briefly mention this broader context, together with an outlook of future research and applications of antiferromagnetic spintronics.
Antiferromagnetic spintronics.
Jungwirth, T; Marti, X; Wadley, P; Wunderlich, J
2016-03-01
Antiferromagnetic materials are internally magnetic, but the direction of their ordered microscopic moments alternates between individual atomic sites. The resulting zero net magnetic moment makes magnetism in antiferromagnets externally invisible. This implies that information stored in antiferromagnetic moments would be invisible to common magnetic probes, insensitive to disturbing magnetic fields, and the antiferromagnetic element would not magnetically affect its neighbours, regardless of how densely the elements are arranged in the device. The intrinsic high frequencies of antiferromagnetic dynamics represent another property that makes antiferromagnets distinct from ferromagnets. Among the outstanding questions is how to manipulate and detect the magnetic state of an antiferromagnet efficiently. In this Review we focus on recent works that have addressed this question. The field of antiferromagnetic spintronics can also be viewed from the general perspectives of spin transport, magnetic textures and dynamics, and materials research. We briefly mention this broader context, together with an outlook of future research and applications of antiferromagnetic spintronics. PMID:26936817
NASA Astrophysics Data System (ADS)
Mumtaz, M.; Khan, Nawazish A.
2009-11-01
The role of charge carriers in ZnO 2/CuO 2 planes of Cu 0.5Tl 0.5Ba 2Ca 3Cu 4-yZn yO 12-δ material in bringing about superconductivity has been explained. Due to suppression of anti-ferromagnetic order with Zn 3d 10 ( S=0) substitution at Cu 3d 9(S={1}/{2}) sites in the inner CuO 2 planes of Cu 0.5Tl 0.5Ba 2Ca 3Cu 4O 12-δ superconductor, the distribution of charge carriers becomes homogeneous and optimum, which is evident from the enhanced superconductivity parameters. The decreased c-axis length with the increase of Zn doping improves interlayer coupling and hence the three dimensional (3D) conductivity in the unit cell is enhanced. Also the softening of phonon modes with the increased Zn doping indicates that the electron-phonon interaction has an essential role in the mechanism of high- Tc superconductivity in these compounds.
Antiferromagnetic ordering in NdAuGe compound
Bashir, A. K. H.; Tchoula Tchokonté, M. B.; Snyman, J. L.; Sondezi, B. M.; Strydom, A. M.
2014-05-07
The compound NdAuGe was investigated by means of electrical resistivity, ρ(T), magnetic susceptibility, χ(T), magnetization, σ(μ{sub 0}H), and specific heat, C{sub p}(T), measurements. Powder X-ray diffraction studies confirm a hexagonal LiGaGe-type structure with space group P6{sub 3}mc (No. 186). ρ(T) data show normal metallic behaviour and a tendency toward saturation at higher temperatures. The low temperature ρ(T) data indicate a phase transition around 3.8 K. The low field dc χ(T) data show an antiferromagnetic anomaly associated with a Néel temperature at T{sub N} = 3.7 K close to the phase transition observed in ρ(T) results. At higher temperatures, χ(T) follows the paramagnetic Curie-Weiss behaviour with an effective magnetic moment μ{sub eff}=3.546(4) μ{sub B} and a paramagnetic Weiss temperature of θ{sub p}=−6.1(4) K. The value obtained for μ{sub eff} is close to the value of 3.62 μ{sub B} expected for the free Nd{sup 3+}-ion. σ(μ{sub 0}H) shows a linear behaviour with applied field up to 3 T with an evidence of metamagnetic behaviour above 3 T. C{sub p}(T) confirms the magnetic phase transition at T{sub N} = 3.4 K. The 4f-electron specific heat indicates a Schottky-type anomaly around 16.5 K with energy splitting Δ{sub 1}=25.8(4) K and Δ{sub 2}=50.7(4) K of the Nd{sup 3+} (J = 9/2) multiplet, that are associated with, respectively, the first and second excited states of the Nd{sup 3+}-ion.
NASA Astrophysics Data System (ADS)
Sadeghi, Azam; Alaei, Mojtaba; Shahbazi, Farhad; Gingras, Michel J. P.
2015-04-01
FeF3, with its half-filled Fe3 +3 d orbital, hence zero orbital angular momentum and S =5 /2 , is often put forward as a prototypical highly frustrated classical Heisenberg pyrochlore antiferromagnet. By employing ab initio density functional theory, we obtain an effective spin Hamiltonian for this material. This Hamiltonian contains nearest-neighbor antiferromagnetic Heisenberg, biquadratic, and Dzyaloshinskii-Moriya interactions as dominant terms and we use Monte Carlo simulations to investigate the nonzero temperature properties of this minimal model. We find that upon decreasing temperature, the system passes through a Coulomb phase, composed of short-range correlated coplanar states, before transforming into an "all-in/all-out" (AIAO) state via a very weakly first-order transition at a critical temperature Tc≈22 K, in good agreement with the experimental value for a reasonable set of Coulomb interaction U and Hund's coupling JH describing the material. Despite the transition being first order, the AIAO order parameter evolves below Tc with a power-law behavior characterized by a pseudo "critical exponent" β ≈0.18 in accord with experiment. We comment on the origin of this unusual β value.
Generation of arbitrary order Bessel beams via 3D printed axicons at the terahertz frequency range.
Wei, Xuli; Liu, Changming; Niu, Liting; Zhang, Zhongqi; Wang, Kejia; Yang, Zhengang; Liu, Jinsong
2015-12-20
We present the generation of arbitrary order Bessel beams at 0.3 THz through the implementation of suitably designed axicons based on 3D printing technology. The helical axicons, which possess thickness gradients in both radial and azimuthal directions, can convert the incident Gaussian beam into a high-order Bessel beam with spiral phase structure. The evolution of the generated Bessel beams are characterized experimentally with a three-dimensional field scanner. Moreover, the topological charges carried by the high-order Bessel beams are determined by the fork-like interferograms. This 3D-printing-based Bessel beam generation technique is useful not only for THz imaging systems with zero-order Bessel beams but also for future orbital-angular-momentum-based THz free-space communication with higher-order Bessel beams. PMID:26837031
Synthesis on structure and properties of zinc nanocrystal in high ordered 3D nanostructures
Sathyaseelan, B.; Manigandan, A.; Anbarasu, V.; Sivakumar, K.
2015-06-24
The wet impregnation method was employed to prepare ZnO encapsulated in mesoporous silica (ZnO/KIT-6). The prepared ZnO/KIT-6 samples have been studied by X-ray diffraction, transmission electron microscope, and nitrogen adsorption–desorption isotherm. The low angle powder XRD patterns of Calcined ZnO/KIT-6 materials showed a phase that can be indexed to cubic Ia3d. Tem images revealed well ordered cubic 3D nanoporous chennels. The ZnO encapsulated in KIT-6 can be used as light-emitting diodes and ultraviolet nanolasers.
Development of Unsteady Aerodynamic and Aeroelastic Reduced-Order Models Using the FUN3D Code
NASA Technical Reports Server (NTRS)
Silva, Walter A.; Vatsa, Veer N.; Biedron, Robert T.
2009-01-01
Recent significant improvements to the development of CFD-based unsteady aerodynamic reduced-order models (ROMs) are implemented into the FUN3D unstructured flow solver. These improvements include the simultaneous excitation of the structural modes of the CFD-based unsteady aerodynamic system via a single CFD solution, minimization of the error between the full CFD and the ROM unsteady aero- dynamic solution, and computation of a root locus plot of the aeroelastic ROM. Results are presented for a viscous version of the two-dimensional Benchmark Active Controls Technology (BACT) model and an inviscid version of the AGARD 445.6 aeroelastic wing using the FUN3D code.
Relativistic Néel-Order Fields Induced by Electrical Current in Antiferromagnets
NASA Astrophysics Data System (ADS)
Železný, J.; Gao, H.; Výborný, K.; Zemen, J.; Mašek, J.; Manchon, Aurélien; Wunderlich, J.; Sinova, Jairo; Jungwirth, T.
2014-10-01
We predict that a lateral electrical current in antiferromagnets can induce nonequilibrium Néel-order fields, i.e., fields whose sign alternates between the spin sublattices, which can trigger ultrafast spin-axis reorientation. Based on microscopic transport theory calculations we identify staggered current-induced fields analogous to the intraband and to the intrinsic interband spin-orbit fields previously reported in ferromagnets with a broken inversion-symmetry crystal. To illustrate their rich physics and utility, we consider bulk Mn2Au with the two spin sublattices forming inversion partners, and a 2D square-lattice antiferromagnet with broken structural inversion symmetry modeled by a Rashba spin-orbit coupling. We propose an antiferromagnetic memory device with electrical writing and reading.
Complex antiferromagnetic order in the Cd6 R approximants to the i- R-Cd quasicrystals
NASA Astrophysics Data System (ADS)
Kreyssig, A.; Beutier, G.; Hoffmann, J.-U.; Kong, T.; Kim, M. G.; Tucker, G. S.; Ueland, B. G.; Hiroto, T.; Liu, D.; Yamada, T.; Boissieu, M. De; Tamura, R.; Bud'Ko, S. L.; Canfield, P. C.; Goldman, A. I.
2014-03-01
The observation of antiferromagnetic order in the Cd6 R (R = rare earths) approximants to the recently discovered related i- R-Cd quasicrystals provides new and exciting opportunities to unravel the nature of magnetism in these materials. We present single-crystal studies employing x-ray and neutron scattering that revealed complex antiferromagnetism in the Cd6 R approximants. Resolution-limited magnetic Bragg peaks have been observed at lattice points forbidden by the center-symmetry and at incommensurate positions demonstrating long-range antiferromagnetic correlations between the R moments. The work at the Ames Laboratory was supported by US DOE, Office of Basic Energy Sciences, DMSE, contract DE-AC02-07CH11358. Work at the Tokyo University of Science was supported by KAKENHI (Grant No. 20045017).
Mapping electronic ordering in chromium in 3D with x-ray microdiffraction
NASA Astrophysics Data System (ADS)
Xu, Ruqing
2015-03-01
In the antiferromagnetic state of chromium, electrons form spin-density waves and charge-density waves with wave vector along one of the lattice cubic axes; the spontaneous ordering of the electrons breaks the lattice symmetry and creates domains within a single crystal. We report the first 3-dimentional mapping of charge-density wave domains in bulk polycrystalline chromium samples using differential-aperture x-ray microdiffraction at the Advanced Photon Source. This research used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No. DE-AC02-06CH11357
Field-Induced Magnonic Liquid in the 3D Spin-Dimerized Antiferromagnet Sr3 Cr2 O8
NASA Astrophysics Data System (ADS)
Wang, Zhe; Quintero-Castro, D. L.; Zherlitsyn, S.; Yasin, S.; Skourski, Y.; Islam, A. T. M. N.; Lake, B.; Deisenhofer, J.; Loidl, A.
2016-04-01
We report on ultrasound and magnetization studies in three-dimensional, spin-dimerized Sr3 Cr2 O8 as a function of temperature and external magnetic field up to 61 T. It is well established [A. A. Aczel et al., Phys. Rev. Lett. 103, 207203 (2009)] that this system exhibits a magnonic-superfluid phase between 30 and 60 T and below 8 K. By mapping ultrasound and magnetization anomalies as a function of magnetic field and temperature we establish that this superfluid phase is embedded in a domelike phase regime of a high-temperature magnonic liquid extending up to 18 K. Compared to thermodynamic results, our study indicates that the magnonic liquid could be characterized by an Ising-like order but has lost the coherence of the transverse components.
Field-Induced Magnonic Liquid in the 3D Spin-Dimerized Antiferromagnet Sr_{3}Cr_{2}O_{8}.
Wang, Zhe; Quintero-Castro, D L; Zherlitsyn, S; Yasin, S; Skourski, Y; Islam, A T M N; Lake, B; Deisenhofer, J; Loidl, A
2016-04-01
We report on ultrasound and magnetization studies in three-dimensional, spin-dimerized Sr_{3}Cr_{2}O_{8} as a function of temperature and external magnetic field up to 61 T. It is well established [A. A. Aczel et al., Phys. Rev. Lett. 103, 207203 (2009)] that this system exhibits a magnonic-superfluid phase between 30 and 60 T and below 8 K. By mapping ultrasound and magnetization anomalies as a function of magnetic field and temperature we establish that this superfluid phase is embedded in a domelike phase regime of a high-temperature magnonic liquid extending up to 18 K. Compared to thermodynamic results, our study indicates that the magnonic liquid could be characterized by an Ising-like order but has lost the coherence of the transverse components. PMID:27104722
Pan, Bingying; Wang, Yang; Zhang, Lijuan; Li, Shiyan
2014-04-01
Single crystals of a metal organic complex (C5H12N)CuBr3 (C5H12N = piperidinium, pipH for short) have been synthesized, and the structure was determined by single-crystal X-ray diffraction. (pipH)CuBr3 crystallizes in the monoclinic group C2/c. Edging-sharing CuBr5 units link to form zigzag chains along the c axis, and the neighboring Cu(II) ions with spin-1/2 are bridged by bibromide ions. Magnetic susceptibility data down to 1.8 K can be well fitted by the Bonner-Fisher formula for the antiferromagnetic spin-1/2 chain, giving the intrachain magnetic coupling constant J ≈ -17 K. At zero field, (pipH)CuBr3 shows three-dimensional (3D) order below TN = 1.68 K. Calculated by the mean-field theory, the interchain coupling constant J' = -0.91 K is obtained and the ordered magnetic moment m0 is about 0.23 μB. This value of m0 makes (pipH)CuBr3 a rare compound suitable to study the 1D-3D dimensional cross-over problem in magnetism, since both 3D order and one-dimensional (1D) quantum fluctuations are prominent. In addition, specific heat measurements reveal two successive magnetic transitions with lowering temperature when external field μ0H ≥ 3 T is applied along the a' axis. The μ0H-T phase diagram of (pipH)CuBr3 is roughly constructed. PMID:24617285
NASA Astrophysics Data System (ADS)
Bauer, Johannes; Sachdev, Subir
2015-08-01
We study charge-ordered solutions for fermions on a square lattice interacting with dynamic antiferromagnetic fluctuations. Our approach is based on real-space Eliashberg equations, which are solved self-consistently. We first show that the antiferromagnetic fluctuations can induce arc features in the spectral functions, as spectral weight is suppressed at the hot spots; however, no real pseudogap is generated. At low temperature, spontaneous charge order with a d -form factor can be stabilized for certain parameters. As long as the interacting Fermi surfaces possess hot spots, the ordering wave vector corresponds to the diagonal connection of the hot spots, similar to the non-self-consistent case. Tendencies towards observed axial order only appear in situations without hot spots.
3D Ordered Mesoporous Bifunctional Oxygen Catalyst for Electrically Rechargeable Zinc-Air Batteries.
Park, Moon Gyu; Lee, Dong Un; Seo, Min Ho; Cano, Zachary Paul; Chen, Zhongwei
2016-05-01
To enhance energy efficiency and durability, a highly active and durable 3D ordered mesoporous cobalt oxide framework has been developed for rechargeable zinc-air batteries. The bifunctional air electrode consisting of 3DOM Co3 O4 having high active surface area and robust structure, results in superior charge and discharge battery voltages, and durable performance for electrically rechargeable zinc-air batteries. PMID:27043451
Extension of Efficient Low Dissipative High Order Schemes for 3-D Curvilinear Moving Grids
NASA Technical Reports Server (NTRS)
Vinokur, Marcel; Yee H. C.; Koga, Dennis (Technical Monitor)
2000-01-01
The efficient low dissipative high order schemes proposed by Yee et al. is formulated for 3-D curvilinear moving grids. These schemes consists of a high order base schemes combined with nonlinear characteristic filters. The amount of numerical dissipation is minimized by applying the schemes to the entropy splitting form of the inviscid flux derivatives. The analysis is given for a thermally perfect gas. The main difficulty in the extension of higher order schemes that were formulated in Cartesian coordinates to curvilinear moving grids is the higher order transformed metric evaluations. The higher order numerical evaluation of the transformed metric terms to insure freestream preservation is done in a coordinate invariant manner. The formulation is an improvement over existing formulation of high order scheme in curvilinear moving grids.
Fast and Robust Sixth Order Multigrid Computation for 3D Convection Diffusion Equation.
Wang, Yin; Zhang, Jun
2010-10-15
We present a sixth order explicit compact finite difference scheme to solve the three dimensional (3D) convection diffusion equation. We first use multiscale multigrid method to solve the linear systems arising from a 19-point fourth order discretization scheme to compute the fourth order solutions on both the coarse grid and the fine grid. Then an operator based interpolation scheme combined with an extrapolation technique is used to approximate the sixth order accurate solution on the fine grid. Since the multigrid method using a standard point relaxation smoother may fail to achieve the optimal grid independent convergence rate for solving convection diffusion equation with a high Reynolds number, we implement the plane relaxation smoother in the multigrid solver to achieve better grid independency. Supporting numerical results are presented to demonstrate the efficiency and accuracy of the sixth order compact scheme (SOC), compared with the previously published fourth order compact scheme (FOC). PMID:21151737
Kalnins, E.G.; Kress, J.M.; Miller, W. Jr.
2006-04-15
This article is one of a series that lays the groundwork for a structure and classification theory of second order superintegrable systems, both classical and quantum, in conformally flat spaces. In the first part of the article we study the Staeckel transform (or coupling constant metamorphosis) as an invertible mapping between classical superintegrable systems on different three-dimensional spaces. We show first that all superintegrable systems with nondegenerate potentials are multiseparable and then that each such system on any conformally flat space is Staeckel equivalent to a system on a constant curvature space. In the second part of the article we classify all the superintegrable systems that admit separation in generic coordinates. We find that there are eight families of these systems.
Localized moments and the stability of antiferromagnetic order in Yb3Pt4
NASA Astrophysics Data System (ADS)
Wu, L. S.; Janssen, Y.; Bennett, M. C.; Aronson, M. C.
2012-08-01
We present here the results of electrical resistivity ρ, magnetization M, ac susceptibility χac', and specific heat CM measurements that have been carried out on single crystals of Yb3Pt4 over a wide range of fields and temperatures. The 2.4-K Néel temperature that is found in zero field collapses under field to a first-order transition TN=0 at BCEP=1.85 T. In the absence of antiferromagnetic order, the specific heat CM(T,B), the magnetization M(T,B), and even the resistivity ρ(T,B) all display B/T scaling, indicating that they are dominated by strong paramagnetic fluctuations, where the only characteristic energy scale results from the Zeeman splitting of an energetically isolated, Yb doublet ground state. This paramagnetic scattering disappears with the onset of antiferromagnetic order, revealing Fermi liquid behavior Δρ=AT2 that persists up to the antiferromagnetic phase line TN(B), but not beyond. The first-order character of TN=0 and the ubiquity of the paramagnetic fluctuations imply that non-Fermi-liquid behaviors are absent in Yb3Pt4. In contrast to heavy fermions such as YbRh2Si2, Yb3Pt4 represents an extremely simple regime of f-electron behavior where the Yb moments and conduction electrons are almost decoupled, and where Kondo physics plays little role.
Probing the antiferromagnetic long-range order with Glauber spin states
NASA Technical Reports Server (NTRS)
Cabrera, Guillermo G.
1994-01-01
It is well known that the ground state of low-dimensional antiferromagnets deviates from Neel states due to strong quantum fluctuations. Even in the presence of long-range order, those fluctuations produce a substantial reduction of the magnetic moment from its saturation value. Numerical simulations in anisotropic antiferromagnetic chains suggest that quantum fluctuations over Neel order appear in the form of localized reversal of pairs of neighboring spins. In this paper, we propose a coherent state representation for the ground state to describe the above situation. In the one-dimensional case, our wave function corresponds to a two-mode Glauber state, when the Neel state is used as a reference, while the boson fields are associated to coherent flip of spin pairs. The coherence manifests itself through the antiferromagnetic long-range order that survives the action of quantum fluctuations. The present representation is different from the standard zero-point spin wave state, and is asymptotically exact in the limit of strong anisotropy. The fermionic version of the theory, obtained through the Jordan-Wigner transformation, is also investigated.
Antiferromagnetic order induced by gadolinium substitution in Bi{sub 2}Se{sub 3} single crystals
Kim, S. W.; Jung, M. H.; Vrtnik, S.; Dolinšek, J.
2015-06-22
Magnetic topological insulators can serve as a fundamental platform for various spin-based device applications. We report the antiferromagnetic order induced by the magnetic impurity dopants of Gd in Gd{sub x}Bi{sub 2−x}Se{sub 3} and the systematic results with varying the Gd concentration x ( = 0.14, 0.20, 0.30, and 0.40). The antiferromagnetic order is demonstrated by the magnetic susceptibility, electrical resistivity, and specific heat measurements. The anomaly observed at T{sub N} = 6 K for x ≥ 0.30 shifts towards lower temperature with increasing the magnetic field, indicative of antiferromagnetic ground state. The Gd substitution into Bi{sub 2}Se{sub 3} enables not only tuning the magnetism from paramagnetic to antiferromagnetic for high x (≥ 0.30) but also giving a promising candidate for antiferromagnetic topological insulators.
Self-Assembled 3D Ordered Macroporous Structures for Tissue Engineering Scaffolds
NASA Astrophysics Data System (ADS)
Juan, Wen-Tau; Chung, Kuo-Yuan; Mishra, Narayan; Lin, Keng-Hui
2008-03-01
A simple, inexpensive and fast microfluidic method to fabricate three-dimensional ordered macroporous gel is demonstrated using alginate as the scaffold material. The microfluidic device consists of two concentric micropipettes where one is nested inside the other. Nitrogen gas and aqueous alginate solution with Pluronic F127 are pumped through the inner and the outer channel respectively. Under appropriate conditions, bubbles of a uniform size are generated within the device at few thousand Hz. We show the control over bubble size by the gas pressure and quantitatively predict the size dependence from the geometry of fluidic device. Monodisperse bubbles are collected and self-assemble into crystal structures as wet foam. The alginate solution between bubbles is crosslinked by divalent calcium ions and turns into 3D ordered macroporous gel where the pores are highly interconnected. The pore size can be directly controlled by the bubble size which ranges from few tens microns to few millimeters. This technique promises a versatile and robust way to make 3D ordered tissue engineering scaffolds.
Long-Range Antiferromagnetic Ordering in B-Site Ordered Double Perovskite Ca2ScOsO6.
Russell, David D; Neer, Abbey J; Melot, Brent C; Derakhshan, Shahab
2016-03-01
A new Os-based B-site ordered double perovskite with the chemical composition of Ca2ScOsO6 was successfully synthesized. The crystal structure of the title compound was determined by employing the powder X-ray diffraction method and was found to crystallize in the monoclinic P21/n space group with the cell constants of a = 5.4716(1) Å, b = 5.6165(1) Å, c = 7.8168 (1) Å, and β = 89.889 (2)°. The temperature-dependent magnetic susceptibility data suggest that this novel S = (3)/2 compound undergoes an antiferromagnetic transition at ∼ 69 K. Fitting the high-temperature susceptibility data (100-300 K) to Currie-Weisse behavior showed C = 1.734 emu·K/mol (μeff = 3.72 bohr magnetons) and θ = -341 K, which is indicative of dominant antiferromagnetic interactions. Temperature-dependent specific heat measurements exhibit a λ shape anomaly at 69 K, which is consistent with a long-range ordering of the spins. Because of a triangular arrangement of antiferromagnetically ordered magnetic ions, the system exhibits some degree of geometric magnetic frustration (GMF), but not strongly. Spin-dimer analysis, employing extended Hückel theory, reveals that a dominant exchange interaction exists (along the a crystallographic axis in perovskite layer), which violates the perfect condition for GMF. PMID:26886175
Macroscopic degeneracy and order in the 3D plaquette Ising model
NASA Astrophysics Data System (ADS)
Johnston, Desmond A.; Mueller, Marco; Janke, Wolfhard
2015-07-01
The purely plaquette 3D Ising Hamiltonian with the spins living at the vertices of a cubic lattice displays several interesting features. The symmetries of the model lead to a macroscopic degeneracy of the low-temperature phase and prevent the definition of a standard magnetic order parameter. Consideration of the strongly anisotropic limit of the model suggests that a layered, “fuki-nuke” order still exists and we confirm this with multi-canonical simulations. The macroscopic degeneracy of the low-temperature phase also changes the finite-size scaling corrections at the first-order transition in the model and we see this must be taken into account when analyzing our measurements.
Spin-Lattice-Coupled Order in Heisenberg Antiferromagnets on the Pyrochlore Lattice
NASA Astrophysics Data System (ADS)
Aoyama, Kazushi; Kawamura, Hikaru
2016-06-01
Effects of local lattice distortions on the spin ordering are investigated for the antiferromagnetic classical Heisenberg model on the pyrochlore lattice. It is found by Monte Carlo simulations that the spin-lattice coupling (SLC) originating from site phonons induces a first-order transition into two different types of collinear magnetic ordered states. The state realized at the stronger SLC is cubic symmetric characterized by the magnetic (1/2 ,1/2 ,1/2 ) Bragg peaks, while that at the weaker SLC is tetragonal symmetric characterized by the (1,1,0) ones, each accompanied by the commensurate local lattice distortions. Experimental implications to chromium spinels are discussed.
NASA Astrophysics Data System (ADS)
Gómez Albarracín, F. A.; Rosales, H. D.
2016-04-01
In this paper we present a detailed study of the antiferromagnetic classical Heisenberg model on a bilayer honeycomb lattice in a highly frustrated regime in the presence of a magnetic field. This study shows strong evidence of entropic order-by-disorder selection in different sectors of the magnetization curve. For antiferromagnetic couplings J1=Jx=Jp/3 , we find that at low temperatures there are two different regions in the magnetization curve selected by this mechanism with different number of soft and zero modes. These regions present broken Z2 symmetry and are separated by a not fully collinear classical plateau at M =1 /2 . At higher temperatures, there is a crossover from the conventional paramagnet to a cooperative magnet. Finally, we also discuss the low-temperature behavior of the system for a less frustrated region, J1=Jx
Coexistence of charge order and antiferromagnetism in (TMTTF)2SbF6: NMR study
NASA Astrophysics Data System (ADS)
Nomura, K.; Yamamoto, M.; Matsunaga, N.; Hirose, S.; Shimohara, N.; Satoh, T.; Isome, T.; Liu, Y.; Kawamoto, A.
2015-03-01
The electronic state of (TMTTF)2SbF6 was investigated by the 1H and 13C NMR measurements. The temperature dependence of T1-1 in 1H NMR shows a sharp peak associated with the antiferromagnetic transition at TAF=6 K. The temperature dependence of T1-1 is described by the power law T2.4 below TAF. This suggests the nodal gapless spin wave excitation in antiferromagnetic phase. In 13C NMR, two sharp peaks at high temperature region, associated with the inner and the outer carbon sites in TMTTF dimer, split into four peaks below 150 K. It indicates that the charge disproportionation occurs. The degree of charge disproportionation Δρ is estimated as (0.25±0.09)e from the chemical shift difference. This value of Δρ is consistent with that obtained from the infrared spectroscopy. In the antiferromagnetic state (AFI), the observed line shape is well fitted by eight Lorentzian peaks. This suggests that the charge order with the same degree still remains in the AF state. From the line assignment, the AF staggered spin amplitude is obtained as 0.70 μB and 0.24 μB at the charge rich and the poor sites, respectively. These values corresponding to almost 1 μB per dimer are quite different from 0.11 μB of another AF (AFII) state in (TMTTF)2Br with effective higher pressure. As a result, it is understood that the antiferromagnetic staggered spin order is stabilized on the CO state in the AFI phase of (TMTTF)2SbF6.
An efficient flexible-order model for 3D nonlinear water waves
Engsig-Karup, A.P. Bingham, H.B.; Lindberg, O.
2009-04-01
The flexible-order, finite difference based fully nonlinear potential flow model described in [H.B. Bingham, H. Zhang, On the accuracy of finite difference solutions for nonlinear water waves, J. Eng. Math. 58 (2007) 211-228] is extended to three dimensions (3D). In order to obtain an optimal scaling of the solution effort multigrid is employed to precondition a GMRES iterative solution of the discretized Laplace problem. A robust multigrid method based on Gauss-Seidel smoothing is found to require special treatment of the boundary conditions along solid boundaries, and in particular on the sea bottom. A new discretization scheme using one layer of grid points outside the fluid domain is presented and shown to provide convergent solutions over the full physical and discrete parameter space of interest. Linear analysis of the fundamental properties of the scheme with respect to accuracy, robustness and energy conservation are presented together with demonstrations of grid independent iteration count and optimal scaling of the solution effort. Calculations are made for 3D nonlinear wave problems for steep nonlinear waves and a shoaling problem which show good agreement with experimental measurements and other calculations from the literature.
Quantum selection of order in an XXZ antiferromagnet on a Kagome lattice.
Chernyshev, A L; Zhitomirsky, M E
2014-12-01
Selection of the ground state of the kagome-lattice XXZ antiferromagnet by quantum fluctuations is investigated by combining nonlinear spin-wave and real-space perturbation theories. The two methods unanimously favor q=0 over sqrt[3]×sqrt[3] magnetic order in a wide range of the anisotropy parameter 0≤Δ≲0.72. Both approaches are also in accord on the magnitude of the quantum order-by-disorder effect generated by topologically nontrivial, looplike spin-flip processes. A tentative S-Δ phase diagram of the model is proposed. PMID:25526152
Niklowitz, P G; Pfleiderer, C; Keller, T; Vojta, M; Huang, Y-K; Mydosh, J A
2010-03-12
We report for the first time simultaneous microscopic measurements of the lattice constants, the distribution of the lattice constants, and the antiferromagnetic moment in high-purity URu(2)Si(2), combining Larmor and conventional neutron diffraction at low temperatures and pressures up to 18 kbar. Our data demonstrate quantitatively that the small moment in the hidden order (HO) of URu(2)Si(2) is purely parasitic. The excellent experimental conditions we achieve allow us to resolve that the transition line between HO and large-moment antiferromagnetism (LMAF), which stabilizes under pressure, is intrinsically first order and ends in a bicritical point. Therefore, the HO and LMAF must have different symmetry, which supports exotic scenarios of the HO such as orbital currents, helicity order, or multipolar order. PMID:20366444
Resonant x-ray scattering in 3d-transition-metal oxides: Anisotropy and charge orderings
NASA Astrophysics Data System (ADS)
Subías, G.; García, J.; Blasco, J.; Herrero-Martín, J.; Sánchez, M. C.
2009-11-01
The structural, magnetic and electronic properties of transition metal oxides reflect in atomic charge, spin and orbital degrees of freedom. Resonant x-ray scattering (RXS) allows us to perform an accurate investigation of all these electronic degrees. RXS combines high-Q resolution x-ray diffraction with the properties of the resonance providing information similar to that obtained by atomic spectroscopy (element selectivity and a large enhancement of scattering amplitude for this particular element and sensitivity to the symmetry of the electronic levels through the multipole electric transitions). Since electronic states are coupled to the local symmetry, RXS reveals the occurrence of symmetry breaking effects such as lattice distortions, onset of electronic orbital ordering or ordering of electronic charge distributions. We shall discuss the strength of RXS at the K absorption edge of 3d transition-metal oxides by describing various applications in the observation of local anisotropy and charge disproportionation. Examples of these resonant effects are (I) charge ordering transitions in manganites, Fe3O4 and ferrites and (II) forbidden reflections and anisotropy in Mn3+ perovskites, spinel ferrites and cobalt oxides. In all the studied cases, the electronic (charge and/or anisotropy) orderings are determined by the structural distortions.
Polar Order and Frustrated Antiferromagnetism in Perovskite Pb2MnWO6 Single Crystals.
Ivanov, Sergey A; Bush, Alexander A; Stash, Adam I; Kamentsev, Konstantin E; Shkuratov, Valerii Ya; Kvashnin, Yaroslav O; Autieri, Carmine; Di Marco, Igor; Sanyal, Biplab; Eriksson, Olle; Nordblad, Per; Mathieu, Roland
2016-03-21
Single crystals of the multiferroic double-perovskite Pb2MnWO6 have been synthesized and their structural, thermal, magnetic and dielectric properties studied in detail. Pure perovskite-phase formation and stoichiometric chemical composition of the as-grown crystals are confirmed by X-ray single-crystal and powder diffraction techniques as well as energy-dispersive X-ray and inductively coupled plasma mass spectrometry. Detailed structural analyses reveal that the crystals experience a structural phase transition from the cubic space group (s.g.) Fm3̅m to an orthorhombic structure in s.g. Pn21a at about 460 K. Dielectric data suggest that a ferrielectric phase transition takes place at that same temperature, in contrast to earlier results on polycrystalline samples, which reported a transition to s.g. Pnma and an antiferroelectric low-temperature phase. Magnetic susceptibility measurements indicate that a frustrated antiferromagnetic phase emerges below 8 K. Density functional theory based calculations confirm that the cationic order between Mn and W is favorable. The lowest total energy was found for an antiferromagnetically ordered state. However, analyses of the calculated exchange parameters revealed strongly competing antiferromagnetic interactions. The large distance between the magnetic atoms, together with magnetic frustration, is shown to be the main reason for the low value of the ordering temperature observed experimentally. We discuss the structure-property relationships in Pb2MnWO6 and compare these observations to reported results on related Pb2BWO6 perovskites with different B cations. PMID:26954581
Magnetic ordering of the buckled honeycomb lattice antiferromagnet Ba2NiTeO6
NASA Astrophysics Data System (ADS)
Asai, Shinichiro; Soda, Minoru; Kasatani, Kazuhiro; Ono, Toshio; Avdeev, Maxim; Masuda, Takatsugu
2016-01-01
We investigate the magnetic order of the buckled honeycomb lattice antiferromagnet Ba2NiTeO6 and its related antiferromagnet Ba3NiTa2O9 by neutron diffraction measurements. We observe magnetic Bragg peaks below the transition temperatures, and identify propagation vectors for these oxides. A combination of representation analysis and Rietveld refinement leads to a collinear magnetic order for Ba2NiTeO6 and a 120∘ structure for Ba3NiTa2O9 . We find that the spin model of the bilayer triangular lattice is equivalent to that of the two-dimensional buckled honeycomb lattice having magnetic frustration. We discuss the magnetic interactions and single-ion anisotropy of Ni+2 ions for Ba2NiTeO6 in order to clarify the origin of the collinear magnetic structures. Our calculation suggests that the collinear magnetic order of Ba2NiTeO6 is induced by the magnetic frustration and easy-axis anisotropy.
2D and 3D ordered arrays of Co magnetic nanowires
NASA Astrophysics Data System (ADS)
Garcia, J.; Prida, V. M.; Vega, V.; Rosa, W. O.; Caballero-Flores, R.; Iglesias, L.; Hernando, B.
2015-06-01
Cobalt nanowire arrays spatially distributed in 2D and 3D arrangements have been performed by pulsed electrodeposition into the pores of planar and cylindrical nanoporous anodic alumina membranes, respectively. Morphological characterization points out the good filling factor reached by electroplated Co nanowires in both kinds of alumina membranes exhibiting hexagonally self-ordered porous structures. Co nanowires grown in both kinds of alumina templates exhibit the same crystalline phases. DC magnetometry and First Order Reversal Curve (FORC) analysis were carried out in order to determine the overall magnetic behavior for both nanowire array geometries. It is found that when the Co nanowires of two kinds of arrays are perpendicularly magnetized, both hysteresis loops are identical, suggesting that neither the intrinsic magnetic behavior of the nanowires nor the collective one depend on the arrays geometry. FORC analysis performed along the radial direction of the Co nanowire arrays embedded in the cylindrical alumina template reveals that the contribution of each nanowire to the magnetization reversal process involves its specific orientation with respect to the applied field direction. Furthermore, the comparison between the magnetic properties for both kinds of Co nanowire arrays allows discussing about the effect of the cylindrical geometry of the template on the magnetostatic interaction among nanowires.
Fermi surface reconstruction in hole-doped t-J models without long-range antiferromagnetic order
NASA Astrophysics Data System (ADS)
Punk, Matthias; Sachdev, Subir
2012-05-01
We calculate the Fermi surface of electrons in hole-doped, extended t-J models on a square lattice in a regime where no long-range antiferromagnetic order is present, and no symmetries are broken. Using the “spinon-dopon” formalism of Ribeiro and Wen, we show that short-range antiferromagnetic correlations lead to a reconstruction of the Fermi surface into hole pockets which are not necessarily centered at the antiferromagnetic Brillouin zone boundary. The Brillouin zone area enclosed by the Fermi surface is proportional to the density of dopants away from half-filling, in contrast to the conventional Luttinger theorem, which counts the total electron density. This state realizes a “fractionalized Fermi liquid” (FL*), which has been proposed as a possible ground state of the underdoped cuprates; we note connections to recent experiments. We also discuss the quantum phase transition from the FL* state to the Fermi liquid state with long-range antiferromagnetic order.
Order-by-disorder effects in antiferromagnets on face-centered cubic lattice
NASA Astrophysics Data System (ADS)
Batalov, L. A.; Syromyatnikov, A. V.
2016-09-01
We discuss the role of quantum fluctuations in Heisenberg antiferromagnets on face-centered cubic lattice with small dipolar interaction in which the next-nearest-neighbor exchange coupling dominates over the nearest-neighbor one. It is well known that a collinear magnetic structure which contains (111) ferromagnetic planes arranged antiferromagnetically along one of the space diagonals of the cube is stabilized in this model via order-by-disorder mechanism. On the mean-field level, the dipolar interaction forces spin to lie within (111) planes. By considering 1 / S corrections to the ground state energy, we demonstrate that quantum fluctuations lead to an anisotropy within (111) planes favoring three equivalent directions for the staggered magnetization (e.g., [ 11 2 bar ], [ 1 2 bar 1 ], and [ 2 bar 11 ] directions for (111) plane). Such in-plane anisotropy was obtained experimentally in related materials MnO, α-MnS, α-MnSe, EuTe, and EuSe. We find that the order-by-disorder mechanism can contribute significantly to the value of the in-plane anisotropy in EuTe. Magnon spectrum is also derived in the first order in 1 / S.
Antiferromagnetism and Hidden Order in Isoelectronic Doping of URu2Si2
NASA Astrophysics Data System (ADS)
Wilson, Murray; Williams, Travis; Cai, Yipeng; Hallas, Alannah; Medina, Teresa; Munsie, Timothy; Cheung, Sky; Liu, Lian; Frandsen, Benjamen; Uemura, Yasutomo; Luke, Graeme
URu2Si2 has been studied for three decades to understand its unusual hidden order state. Doping of this compound on the Ru site usually causes the transition temperature to decrease and hidden order to transition to magnetic order. In contrast, the isoelectronic dopings Fe and Os cause a substantial increase in the transition temperature over a wide range of dopings, with Fe in particular mimicking applied hydrostatic pressure. However, until recently, the magnetic states of these dopings have not been well characterized. In the past year, neutron scattering results have been reported on Fe doping that show antiferromagnetism with moments that are twice as large as those measured for pure URu2Si2 under pressure. In this talk we present an investigation of the magnetic properties of single crystal samples of URu-xFexSi2 and URu2-xOsxSi2 by muon spin rotation (μSR) and susceptibility. Our μSR results demonstrate that both of these dopings show an antiferromagnetic ground state with internal fields comparable to pure URu2Si2 under pressure. Interpretation of our data indicates that the evolution of magnetism with doping for both Fe and Os is driven by changes in hybridization.
B-site ordered perovskite LaSrMnNbO{sub 6}: Synthesis, structure and antiferromagnetism
Yang Tao; Perkisas, Tyche; Hadermann, Joke; Croft, Mark; Ignatov, Alexander; Greenblatt, Martha
2010-11-15
LaSrMnNbO{sub 6} has been synthesized by high temperature solid state reaction under 1% H{sub 2}/Ar dynamic flow. The structure is determined by Rietveld refinement of the powder X-ray diffraction data. It crystallizes in the monoclinic space group P2{sub 1}/n with the unit cell parameters: a=5.69187(12), b=5.74732(10), c=8.07018(15) A and {beta}=90.0504(29){sup o}, which were also confirmed by electron diffraction. The Mn{sup 2+} and Nb{sup 5+} ions, whose valence states are confirmed by X-ray absorption near-edge spectroscopy, are almost completely ordered over the B-site (<1% inversion) of the perovskite structure due to the large differences of both cationic size (0.19 A) and charge. The octahedral framework displays significant tilting distortion according to Glazer's tilt system a{sup -}b{sup -}c{sup +}. Upon heating, LaSrMnNbO{sub 6} decomposes at 690 {sup o}C under O{sub 2} flow or at 775 {sup o}C in air. The magnetic susceptibility data indicate the presence of long-range antiferromagnetic ordering at T{sub N}=8 K; the experimentally observed effective paramagnetic moment, {mu}{sub eff}=5.76 {mu}{sub B} for high spin Mn{sup 2+} (3d{sup 5}, S=5/2) is in good agreement with the calculated value ({mu}{sub calcd}=5.92 {mu}{sub B}). -- Graphical abstract: An ordered double perovskite, LaSrMnNbO{sub 6} has been synthesized in the monoclinic space group P2{sub 1}/n. The Mn{sup 2+} and Nb{sup 5+} ions, whose valence states are confirmed by X-ray absorption near-edge spectroscopy, are ordered over the B-site. The magnetic susceptibility data indicate long-range antiferromagnetic ordering at T{sub N}=8 K. Display Omitted
Kreyssig, Andreas; Beutier, Guillaume; Hiroto, Takanobu; Kim, Min Gyu; Tucker, Gregory S.; de Boissieu, Marc; Tamura, Ryuji; Goldman, Alan I.
2014-09-22
It has generally been accepted that the orientational ordering of the Cd_{4} tetrahedron within the Cd_{6} R quasicrystal approximants is kinetically inhibited for R = Ho, Er, Tm and Lu by steric constraints. Our high-resolution X-ray scattering measurements of the Cd_{6}Ho quasicrystal approximant, however, reveal an abrupt (first-order) transition to a monoclinic structure below T _{S} = 178 K for samples that have ‘aged’ at room temperature for approximately one year, reopening this question. Using X-ray resonant magnetic scattering at the Ho L _{3}-edge we have elucidated the nature of the antiferromagnetic ordering below T _{N} = 8.5 K in Cd_{6}Ho. The magnetic Bragg peaks are found at the charge forbidden H + K + L = 2n + 1 positions, referenced to the high-temperature body-centred cubic structure. In general terms, this corresponds to antiferromagnetic arrangements of the Ho moments on adjacent clusters in the unit cell as previously found for Cd_{6}Tb.
Edge-Imposed Domain Ordering in Antiferromagnetic LaFeO3 Nanostructures
NASA Astrophysics Data System (ADS)
Grepstad, J. K.; Folven, E.; Tybell, T.; Scholl, A.; Young, A.; Retterer, S. T.; Takamura, Y.
2011-03-01
The antiferromagnetic (AFM) domain structure of submicron-sized LaFe O3 nanostructures was imaged with photoemission electron microscopy in combination with x-ray magnetic linear dichroism. These nanostructures were defined in epitaxial LaFe O3 thin films using e-beam lithography and Ar + ion implantation to locally destroy the magnetic order in the surrounding matrix. Extended domains were found to form along the perimeter of rectangular-shaped islands, when their edges were aligned with the in-plane < 100 > axes of the cubic SrTiO substrate. The AFM spin axis of these domains was confined to lie within the film plane, aligned with the edges of the nanostructures. This domain configuration predominated for nanoislands scaled down to 500x500 nm . However, no edge-imposed domain ordering was observed for rectangular islands rotated by 45 with respect to the in-plane crystalline axes, suggesting a magnetocrystalline origin of the extended edge-bound AFM domains. These findings may prove important to spintronic devices relying on exchange-biased nanostructures, where domain engineering in antiferromagnets remains relatively unexplored and has the potential to provide new device opportunities. This work was sponsored by the DoE BES and the Div. of Scientific User Facilities, US DoE, and by the Research Council of Norway.
Amperometric biosensor based on 3D ordered freestanding porous Pt nanowire array electrode.
Wang, Yunli; Zhu, Yingchun; Chen, Jingjing; Zeng, Yi
2012-09-28
A three-dimensionally (3D) ordered freestanding porous platinum (Pt) nanowire array electrode (PPNWAE) with pores of several nanometers in size and a Pt nanowire array electrode (PNWAE) without pores were facilely fabricated by metal electrodeposition and direct integration with a Pt disk electrode. The unusual PPNWAE with high active area showed excellent sensitivity (0.36 mA cm(-2) mM(-1)) and a wide detection range (4.5 μM-27.1 mM) to hydrogen peroxide (H(2)O(2)). A glucose oxidase (GOD)-based biosensor (PPNWAE/GOD) with a considerably wide detection range (4.5 μM-189.5 mM) to glucose was demonstrated. Furthermore, a lower detection limit, higher sensitivity and smaller value of Michaelis-Menten constant k(m) were recorded for PPNWAE-based biosensors compared with PNWAE-based biosensors. Particularly, the response current to glucose of PPNWAE/GOD was ca. 100% higher than that of PNWAE/GOD and the response current to H(2)O(2) of PPNWAE was ca. 50% higher than that of PNWAE, owing to the granular and rougher porous nanowire surface enabling greater bioactivity for GOD. The selectivity of PPNWAE/GOD glucose biosensor was also estimated. PMID:22898987
Anisotropic intrinsic anomalous Hall effect in ordered 3dPt alloys
NASA Astrophysics Data System (ADS)
Zhang, Hongbin; Blügel, Stefan; Mokrousov, Yuriy
2011-07-01
By performing first-principles calculations, we investigate the intrinsic anomalous Hall conductivity (AHC) and its anisotropy in ordered L10 FePt, CoPt, and NiPt ferromagnets and their intermediate alloys. We demonstrate that the AHC in this family of compounds depends strongly on the direction of the magnetization M in the crystal. We predict that such pronounced orientational dependence in combination with the general decreasing trend of the AHC when going from FePt to NiPt leads to a sign change of the AHC upon rotating the magnetization direction in the crystal of CoPt alloy. We also suggest that, for a range of concentration x in CoxNi1-xPt and FexCo1-xPt alloys, it is possible to achieve a complete quenching of the anomalous Hall current for a certain direction of the magnetization in the crystal. By analyzing the spin-resolved AHC in 3dPt alloys, we endeavor to relate the overall trend of the AHC in these compounds to the changes in their densities of d states around the Fermi energy upon varying the atomic number. Moreover, we show the generality of the phenomenon of anisotropic anomalous Hall effect by demonstrating its occurrence within the three-band tight-binding model.
Magnetic field penetration into a 3D ordered Josephson medium and applicability of the bean model
NASA Astrophysics Data System (ADS)
Zelikman, M. A.
2014-11-01
The results of calculation of penetration of an external magnetic field into a 3D ordered Josephson medium, based on analysis of modification of the configuration in the direction of the decrease in its Gibbs potential, are reported. When the external field slightly exceeds the stability threshold, the Meissner configuration is transformed into a periodic sequence of linear vortices, which are parallel to the boundary of the medium and are located at a certain distance from it. There exists a critical value I C separating two possible regimes of penetration of the external magnetic field into the medium. For I > I C, for any value of the external field, a finite-length boundary current configuration appears, which completely compensates the external field in the bulk of the sample. At the sample boundary, the field decreases with increasing depth almost linearly. The values of the slope of the magnetic field dependence are rational fractions, which remain constant in finite intervals of I. When the value of I exceeds the upper boundary of such an interval, the slope increases and assumes the value of another rational fraction. If, however, I < I C, such a situation takes place only up to a certain value of external field H max. For higher values, the field penetrates into the medium to an infinite depth. These results lead to the conclusion that the Bean assumptions are violated and that Bean's model is inapplicable for analyzing the processes considered here.
Antiferromagnetic order in the pyrochlores R2Ge2O7 (R = Er, Yb)
NASA Astrophysics Data System (ADS)
Dun, Zhiling; Li, Xiang; Freitas, Rafael; Arrighi, Everton; Cruz, Clarina; Lee, Minseong; Choi, Eun Sang; Cao, Huibo; Silverstein, Harlyn; Wiebe, Chris; Chen, Jinguang; Zhou, Haidong
Elastic neutron scattering, ac susceptibility, and specific heat experiments on the pyrochlores Er2Ge2O7 and Yb2Ge2O7 show that both systems are antiferromagnetically ordered in the Γ5 manifold. The ground state is a ψ3 phase for the Er sample and a ψ2 or ψ3 phase for the Yb sample, which suggests ``Order by Disorder''(ObD) physics. Furthermore, we unify the various magnetic ground states of all known R2X2O7 (R = Er, Yb, X = Sn, Ti, Ge) compounds through the enlarged XY type exchange interaction J+/- under chemical pressure. The mechanism for this evolution is discussed in terms of the phase diagram proposed in the theoretical study [Wong et al., Phys. Rev. B 88, 144402, (2013)].
Antiferromagnetic order in the pyrochlores R2Ge2O7 (R =Er ,Yb )
NASA Astrophysics Data System (ADS)
Dun, Z. L.; Li, X.; Freitas, R. S.; Arrighi, E.; Dela Cruz, C. R.; Lee, M.; Choi, E. S.; Cao, H. B.; Silverstein, H. J.; Wiebe, C. R.; Cheng, J. G.; Zhou, H. D.
2015-10-01
Elastic neutron scattering, ac susceptibility, and specific heat experiments on the pyrochlores Er2Ge2O7 and Yb2Ge2O7 show that both systems are antiferromagnetically ordered in the Γ5 manifold. The ground state is a ψ3 phase for the Er sample and a ψ2 or ψ3 phase for the Yb sample, which suggests "Order by Disorder" physics. Furthermore, we unify the various magnetic ground states of all known R2X2O7 (R =Er , Yb; X =Sn , Ti, Ge) compounds through the enlarged X Y -type exchange interaction J± under chemical pressure. The mechanism for this evolution is discussed in terms of the phase diagram proposed in the theoretical study by Wong et al. [Phys. Rev. B 88, 144402 (2013), 10.1103/PhysRevB.88.144402].
Optical Signatures of Antiferromagnetic Ordering of Fermionic Atoms in an Optical Lattice
NASA Astrophysics Data System (ADS)
Cordobes Aguilar, Francisco; Ho, Andrew F.; Ruostekoski, Janne
2014-07-01
We show how off-resonant light scattering can provide quantitative information on antiferromagnetic ordering of a two-species fermionic atomic gas in a tightly-confined two-dimensional optical lattice. We analyze the emerging magnetic ordering of atoms in the mean-field and in random phase approximations and show how the many-body static and dynamic correlations, evaluated in the standard Feynman-Dyson perturbation series, can be detected in the scattered light signal. The staggered magnetization reveals itself in the magnetic Bragg peaks of the individual spin components. These magnetic peaks, however, can be considerably suppressed in the absence of a true long-range antiferromagnetic order. The light scattered outside the diffraction orders can be collected by a lens with highly improved signal-to-shot-noise ratio when the diffraction maxima are blocked. The collective and single-particle excitations are identified in the spectrum of the scattered light. We find that the spin-conserving and spin-exchanging atomic transitions convey information on density, longitudinal spin, and transverse spin correlations. The different correlations and scattering processes exhibit characteristic angular distribution profiles for the scattered light, and e.g., the diagnostic signal of transverse spin correlations could be separated from the optical response by the scattering direction, frequency, or polarization. We also analyze the detection accuracy by estimating the number of required measurements, constrained by the heating rate that is determined by inelastic light-scattering events. The imaging technique could be extended to the two-species fermionic states in other regions of the phase diagram where the ground-state properties are still not fully understood.
"Quasi-Antiferromagnetic" Ordering in the R-Mg-Zn Icosahedral Alloys? The Case of Tb-Mg-Zn
NASA Astrophysics Data System (ADS)
Goldman, A. I.; Islam, Z.; Fisher, I. R.; Panchula, A. F.; Cheon, K. O.; Canfield, P. C.; Stassis, C.; Zarestky, J.
1998-03-01
Recently, it was reported that long-range magnetic ordering was observed in several of the new rare earth containing icosahedral alloys, R-Mg-Zn (R=Tb, Dy, Ho, Er) (B. Charrier et al., Phys. Rev. Lett. 78, 4637, 1997.). At low temperatures, the antiferromagnetic Bragg peaks, while weak, could be indexed to the icosahedral parent phase with good accuracy. In addition, significant magnetic diffuse scattering, indicating only short-range magnetic order, was also observed. However, bulk magnetization measurements have evidenced only a spin-glass transition at low temperatures, and no antiferromagnetic transition. We will report on new neutron scattering measurements of the magnetic order in Tb-Mg-Zn powder samples produced from crushed single-crystals, used to improve sample purity. Our results for these samples show only the diffuse component of the magnetic scattering at low temperature, and no antiferromagnetic Bragg peaks. We will discuss several possibilities for the discrepencies between the two experiments.
Antiferromagnetism and hidden order in isoelectronic doping of URu2Si2
Wilson, Murray N.; Williams, Travis J.; Cai, Yipeng; Hallas, Alannah M.; Medina, Teresa; Munsie, Timothy J.; Cheung, Sky C.; Frandsen, Benjamin A.; Liu, Lian; Uemura, Yasutomo J.; et al
2016-02-01
In this paper, we present muon spin rotation (mu SR) and susceptibility measurements on single crystals of isoelectronically doped URu2-xTxSi2 (T = Fe, Os) for doping levels up to 50%. Zero field (ZF) μ SR measurements show long-lived oscillations demonstrating that an antiferromagnetic state exists down to low doping levels for both Os and Fe dopants. The measurements further show an increase in the internal field with doping for both Fe and Os. Comparison of the local moment-hybridization crossover temperature from susceptibility measurements and our magnetic transition temperature shows that changes in hybridization, rather than solely chemical pressure, are importantmore » in driving the evolution of magnetic order with doping.« less
Magnetic behavior of Eu(3)Ni(4)Ga(4): antiferromagnetic order and large magnetoresistance.
Anupam; Geibel, C; Hossain, Z
2012-08-15
The results of the magnetic susceptibility, isothermal magnetization, heat capacity, electrical resistivity and magnetoresistance measurements on polycrystalline Eu(3)Ni(4)Ga(4) are presented. Eu(3)Ni(4)Ga(4) forms in Na(3)Pt(4)Ge(4)-type cubic crystal structure (space group [Formula: see text]). The temperature dependence of the magnetic susceptibility of Eu(3)Ni(4)Ga(4) confirms the divalent state (Eu(2+)) of Eu ions with an effective magnetic moment μ(eff) = 7.98 μ(B). At low fields, e.g. at 0.01 T, a magnetic phase transition to an antiferromagnetically ordered state occurs at T(N) = 10.9 K, which is further confirmed by the temperature dependence of the heat capacity and electrical resistivity. The field dependence of isothermal magnetization at 2 K reveals the presence of two field induced metamagnetic transitions at H(c1) and H(c2) = 0.55 and 1.2 T, respectively and a polarized phase above H(PO) = 1.7 T. The reduced jump in the heat capacity at the transition temperature, ΔC|(T(N)) = 13.48 J/mol-Eu K would indicate an amplitude modulated (AM) antiferromagnetic structure. An interesting feature is that a large negative magnetoresistance, MR = [ρ(H) - ρ(0)]/ρ(0), is observed in the vicinity of magnetic transition even up to 2T(N). Similar large magnetoresistance has been observed in the paramagnetic state in some Gd and Eu based alloys and has been attributed to the magneto-polaronic effect. PMID:22785157
NASA Astrophysics Data System (ADS)
Li, Yingmin; Wang, Jiaxi; Clark, Melissa L.; Kubiak, Clifford P.; Xiong, Wei
2016-04-01
We report the first fourth-order 3D SFG spectroscopy of a monolayer of the catalyst Re(diCN-bpy)(CO)3Cl on a gold surface. Besides measuring the vibrational coherences of single vibrational modes, the fourth-order 3D SFG spectrum also measures the dynamics of interstate coherences and vibrational coherences states between two vibrational modes. By comparing the 3D SFG to the corresponding 2D and third-order 3D IR spectroscopy of the same molecules in solution, we found that the interstate coherences exist in both liquid and surface systems, suggesting that the interstate coherence is not disrupted by surface interactions. However, by analyzing the 3D spectral lineshape, we found that the interstate coherences also experience non-negligible homogenous dephasing dynamics that originate from surface interactions. This unique ability of determining interstate vibrational coherence dynamics of the molecular monolayer can help in understanding of how energy flows within surface catalysts and other molecular monolayers.
Observation of antiferromagnetic order collapse in the pressurized insulator LaMnPO
Guo, Jing; Simonson, J. W.; Sun, Liling; Wu, Qi; Gao, Peiwen; Zhang, Chao; Gu, Dachun; Kotliar, Gabriel; Aronson, Meigan; Zhao, Zhongxian
2013-01-01
The emergence of superconductivity in the iron pnictide or cuprate high temperature superconductors usually accompanies the suppression of a long-ranged antiferromagnetic (AFM) order state in a corresponding parent compound by doping or pressurizing. A great deal of effort by doping has been made to find superconductivity in Mn-based compounds, which are thought to bridge the gap between the two families of high temperature superconductors, but the AFM order was not successfully suppressed. Here we report the first observations of the pressure-induced elimination of long-ranged AFM order at ~ 34 GPa and a crossover from an AFM insulating to an AFM metallic state at ~ 20 GPa in LaMnPO single crystals that are iso-structural to the LaFeAsO superconductor by in-situ high pressure resistance and ac susceptibility measurements. These findings are of importance to explore potential superconductivity in Mn-based compounds and to shed new light on the underlying mechanism of high temperature superconductivity. PMID:23989921
Xue, Chaowen; Shi, Xiaotong; Fang, Xuan; Tao, Haiyan; Zhu, Hui; Yu, Fen; Ding, Xingwei; Liu, Miaoxing; Fang, Fang; Yang, Fan; Wei, Zhipeng; Chen, Tingtao; Wang, Zongliang; Wang, Guoping; Cheng, Xigao; Wei, Junchao; Lin, Yingjie; Deng, Keyu; Wang, Xiaolei; Xin, Hongbo
2016-04-01
For the first time, homogeneous and well-ordered functional nanoarrays were grown densely on the complex structured three-dimensional (3D) printing frameworks through a general plasma enhanced atomic layer deposition (PEALD) assisted hydrothermal surface engineering process. The entire process was free from toxic additives or harmful residues and, therefore, can meet the critical requirements of high-purity products. As a practical example, 3D customized earplugs were precisely manufactured according to the model of ear canals at the 0.1 mm level. Meanwhile, well-ordered ZnO nanoarrays, formed on the surfaces of these 3D printed earplugs, could effectively prevent the growth of five main pathogens derived from the patients with otitis media and exhibited excellent wear resistance as well. On the basis of both animal experiments and volunteers' investigations, the 3D customized earplugs showed sound insulation capabilities superior to those of traditional earplugs. Further animal experiments demonstrated the potential of as-modified implant scaffolds in practical clinical applications. This work, exemplified with earplugs and implant scaffolds, oriented the development direction of 3D printing in biomedical devices, which precisely integrated customized architecture and tailored surface performance. PMID:26974545
Novel and simple route to fabricate 2D ordered gold nanobowl arrays based on 3D colloidal crystals.
Rao, Yanying; Tao, Qin; An, Ming; Rong, Chunhui; Dong, Jian; Dai, Yurong; Qian, Weiping
2011-11-01
In this study, we present a new method to fabricate large-area two-dimensionally (2D) ordered gold nanobowl arrays based on 3D colloidal crystals by wet chemosynthesis, which combines the advantages of a very simple preparation and an applicability to "real" nanomaterials. By combination of in situ growth of gold nanoshell (GNSs) arrays based on three-dimensional (3D) colloidal silica crystals, a monolayer ordered reversed GNS array (2D ordered GNS array) was conveniently manufactured by an acrylic ester modified biaxial oriented polypropylene (BOPP). 2D ordered gold nanobowl array with adjustable periodic holes, good stability, reproducibility, and repeatability could be obtained when the silica core was etched by HF solution. The surface-enhanced Raman scattering (SERS) enhancement factor (EF) of this 2D ordered gold nanobowl array could reach 1.27 × 10(7), which shows high SERS enhancing activity and can be used as a universal SERS substrate. PMID:21932785
Transitions to valence-bond solid order in a honeycomb lattice antiferromagnet
NASA Astrophysics Data System (ADS)
Pujari, Sumiran; Alet, Fabien; Damle, Kedar
2015-03-01
We use quantum Monte Carlo methods to study the ground-state phase diagram of a S =1 /2 honeycomb lattice magnet in which a nearest-neighbor antiferromagnetic exchange J (favoring Néel order) competes with two different multispin interaction terms: a six-spin interaction Q3 that favors columnar valence-bond solid (VBS) order, and a four-spin interaction Q2 that favors staggered VBS order. For Q3˜Q2≫J , we establish that the competition between the two different VBS orders stabilizes Néel order in a large swath of the phase diagram even when J is the smallest energy scale in the Hamiltonian. When Q3≫(Q2,J ) [ Q2≫(Q3,J ) ], this model exhibits at zero temperature phase transition from the Néel state to a columnar (staggered) VBS state. We establish that the Néel-columnar VBS transition is continuous for all values of Q2, and that critical properties along the entire phase boundary are well characterized by critical exponents and amplitudes of the noncompact CP1 (NCCP1) theory of deconfined criticality, similar to what is observed on a square lattice. However, a surprising threefold anisotropy of the phase of the VBS order parameter at criticality, whose presence was recently noted at the Q2=0 deconfined critical point, is seen to persist all along this phase boundary. We use a classical analogy to explore this by studying the critical point of a three-dimensional X Y model with a fourfold anisotropy field which is known to be weakly irrelevant at the three-dimensional X Y critical point. In this case, we again find that the critical anisotropy appears to saturate to a nonzero value over the range of sizes accessible to our simulations.
Pérez-Aguirre, Rubén; Beobide, Garikoitz; Castillo, Oscar; de Pedro, Imanol; Luque, Antonio; Pérez-Yáñez, Sonia; Rodríguez Fernández, Jesús; Román, Pascual
2016-08-01
The present work provides two new examples of supramolecular metal-organic frameworks consisting of three-dimensional extended noncovalent assemblies of wheel-shaped heptanuclear [Cu7(μ-H2O)6(μ3-OH)6(μ-adeninato-κN3:κN9)6](2+) entities. The heptanuclear entity consists of a central [Cu(OH)6](4-) core connected to six additional copper(II) metal centers in a radial and planar arrangement through the hydroxides. It generates a wheel-shaped entity in which water molecules and μ-κN3:κN9 adeninato ligands bridge the peripheral copper atoms. The magnetic characterization indicates the central copper(II) center is anti-ferromagnetically coupled to external copper(II) centers, which are ferromagnetically coupled among them leading to an S = 5/2 ground state. The packing of these entities is sustained by π-π stacking interactions between the adenine nucleobases and by hydrogen bonds established among the hydroxide ligands, sulfate anions, and adenine nucleobases. The sum of both types of supramolecular interactions creates a rigid synthon that in combination with the rigidity of the heptameric entity generates an open supramolecular structure (40-50% of available space) in which additional sulfate and triethylammonium ions are located altogether with solvent molecules. These compounds represent an interesting example of materials combining both porosity and magnetic relevant features. PMID:27409976
Antiferromagnetic Ordering in the Single-Component Molecular Conductor [Pd(tmdt)2].
Ogura, Satomi; Idobata, Yuki; Zhou, Biao; Kobayashi, Akiko; Takagi, Rina; Miyagawa, Kazuya; Kanoda, Kazushi; Kasai, Hidetaka; Nishibori, Eiji; Satoko, Chikatoshi; Delley, Bernard
2016-08-01
Crystals of [Pd(tmdt)2] (tmdt = trimethylenetetrathiafulvalenedithiolate) were prepared in order to investigate their physical properties. The electrical resistivity of [Pd(tmdt)2] was measured on single crystals using two-probe methods and showed that the room-temperature conductivity was 100 S·cm(-1). The resistivity behaviors implied that [Pd(tmdt)2] was a semimetal at approximately room temperature and became narrow-gap semiconducting as the temperature was decreased to the lowest temperature. X-ray structural studies on small single crystals of [Pd(tmdt)2] at temperatures of 20-300 K performed using synchrotron radiation at SPring-8 showed no distinct structural change over this temperature region. However, small anomalies were observed at approximately 100 K. Electron spin resonance (ESR) spectra were measured over the temperature range of 2.7-301 K. The ESR intensity increased as the temperature decreased to 100 K and then decreased linearly as the temperature was further decreased to 50 K, where an abrupt decrease in the intensity was observed. To investigate the magnetic state, (1)H nuclear magnetic resonance (NMR) measurements were performed in the temperature range of 2.5-271 K, revealing broadening below 100 K. The NMR relaxation rate gradually increased below 100 K and formed a broad peak at approximately 50 K, followed by a gradual decrease down to the lowest temperature. These results suggest that most of the sample undergoes the antiferromagnetic transition at approximately 50 K with the magnetic ordering temperatures distributed over a wide range up to 100 K. These electric and magnetic properties of [Pd(tmdt)2] are quite different from those of the single-component molecular (semi)metals [Ni(tmdt)2] and [Pt(tmdt)2], which retain their stable metallic states down to extremely low temperatures. The experimental results and the band structure calculations at the density functional theory level showed that [Pd(tmdt)2] may be an antiferromagnetic Mott
Khuntia, P; Bert, F; Mendels, P; Koteswararao, B; Mahajan, A V; Baenitz, M; Chou, F C; Baines, C; Amato, A; Furukawa, Y
2016-03-11
PbCuTe_{2}O_{6} is a rare example of a spin liquid candidate featuring a three-dimensional magnetic lattice. Strong geometric frustration arises from the dominant antiferromagnetic interaction that generates a hyperkagome network of Cu^{2+} ions although additional interactions enhance the magnetic lattice connectivity. Through a combination of magnetization measurements and local probe investigations by NMR and muon spin relaxation down to 20 mK, we provide robust evidence for the absence of magnetic freezing in the ground state. The local spin susceptibility probed by the NMR shift hardly deviates from the macroscopic one down to 1 K pointing to a homogeneous magnetic system with a low defect concentration. The saturation of the NMR shift and the sublinear power law temperature (T) evolution of the 1/T_{1} NMR relaxation rate at low T point to a nonsinglet ground state favoring a gapless fermionic description of the magnetic excitations. Below 1 K a pronounced slowing down of the spin dynamics is witnessed, which may signal a reconstruction of spinon Fermi surface. Nonetheless, the compound remains in a fluctuating spin liquid state down to the lowest temperature of the present investigation. PMID:27015508
Khuntia, P.; Bert, F.; Mendels, P.; Koteswararao, B.; Mahajan, A. V.; Baenitz, M.; Chou, F. C.; Baines, C.; Amato, A.; Furukawa, Y.
2016-03-11
In this study, PbCuTe2O6 is a rare example of a spin liquid candidate featuring a three-dimensional magnetic lattice. Strong geometric frustration arises from the dominant antiferromagnetic interaction that generates a hyperkagome network of Cu2+ ions although additional interactions enhance the magnetic lattice connectivity. Through a combination of magnetization measurements and local probe investigations by NMR and muon spin relaxation down to 20 mK, we provide robust evidence for the absence of magnetic freezing in the ground state. The local spin susceptibility probed by the NMR shift hardly deviates from the macroscopic one down to 1 K pointing to a homogeneousmore » magnetic system with a low defect concentration. The saturation of the NMR shift and the sublinear power law temperature (T) evolution of the 1/T1 NMR relaxation rate at low T point to a nonsinglet ground state favoring a gapless fermionic description of the magnetic excitations. Below 1 K a pronounced slowing down of the spin dynamics is witnessed, which may signal a reconstruction of spinon Fermi surface. Nonetheless, the compound remains in a fluctuating spin liquid state down to the lowest temperature of the present investigation.« less
NASA Astrophysics Data System (ADS)
Khuntia, P.; Bert, F.; Mendels, P.; Koteswararao, B.; Mahajan, A. V.; Baenitz, M.; Chou, F. C.; Baines, C.; Amato, A.; Furukawa, Y.
2016-03-01
PbCuTe2O6 is a rare example of a spin liquid candidate featuring a three-dimensional magnetic lattice. Strong geometric frustration arises from the dominant antiferromagnetic interaction that generates a hyperkagome network of Cu2 + ions although additional interactions enhance the magnetic lattice connectivity. Through a combination of magnetization measurements and local probe investigations by NMR and muon spin relaxation down to 20 mK, we provide robust evidence for the absence of magnetic freezing in the ground state. The local spin susceptibility probed by the NMR shift hardly deviates from the macroscopic one down to 1 K pointing to a homogeneous magnetic system with a low defect concentration. The saturation of the NMR shift and the sublinear power law temperature (T ) evolution of the 1 /T1 NMR relaxation rate at low T point to a nonsinglet ground state favoring a gapless fermionic description of the magnetic excitations. Below 1 K a pronounced slowing down of the spin dynamics is witnessed, which may signal a reconstruction of spinon Fermi surface. Nonetheless, the compound remains in a fluctuating spin liquid state down to the lowest temperature of the present investigation.
Helical antiferromagnetic ordering in Lu1-xScxMnSi
Goetsch, Ryan J; Anand, V K; Johnston, David C
2014-08-01
Polycrystalline samples of Lu_{1-x}Sc_{x}MnSi (x=0, 0.25, 0.5) are studied using powder x-ray diffraction, heat capacity Cp, magnetization, magnetic susceptibility χ, and electrical resistivity ρ measurements versus temperature T and magnetic field H. This system crystallizes in the primitive orthorhombic TiNiSi-type structure (space group Pnma) as previously reported. The ρ(T) data indicate metallic behavior. The Cp(T), χ(T), and ρ(T) measurements consistently indicate long-range antiferromagnetic (AF) transitions with AF ordering temperatures TN=246, 215, and 188 K for x=0, 0.25, and 0.5, respectively. A second transition is observed at somewhat lower T for each sample from the χ(T) and ρ(T) measurements, which we speculate are due to spin reorientation transitions; these second transitions are completely suppressed in H=5.5 T. The Cp data below 10 K for each composition indicate an enhanced Sommerfeld electronic heat capacity coefficient for the series in the range γ=24–29 mJ/mol K2. The χ(T) measurements up to 1000 K were fitted by local-moment Curie-Weiss behaviors which indicate a low Mn spin S~1. The χ data below TN are analyzed using the Weiss molecular field theory for a planar noncollinear cycloidal AF structure with a composition-dependent pitch, following the previous neutron diffraction work of Venturini et al. [J. Alloys Compd. 256, 65 (1997)]. Within this model, the fits indicate a turn angle between Mn ordered moments along the cycloid axis of ~100° or ~145°, either of which indicate dominant AF interactions between the Mn spins in the Lu_{1-x}Sc_{x}MnSi series of compounds.
NASA Astrophysics Data System (ADS)
Sato, Ryo; Yokoyama, Hisatoshi
2016-07-01
Band renormalization effects (BRE) are comprehensively studied for a mixed state of dx2 - y2-wave superconducting (d-SC) and antiferromagnetic (AF) orders, in addition to simple d-SC, AF, and normal (paramagnetic) states, by applying a variational Monte Carlo method to a two-dimensional Hubbard (t-t'-U) model. In a weakly correlated regime (U/t ≲ 6), BRE are negligible on all the states studied. As previously shown, the effective band of d-SC is greatly renormalized but the modifications of physical quantities, including energy improvement, are negligible. In contrast, BRE on the AF state considerably affects various features of the system. Because the energy is markedly improved for t'/t < 0, the AF state occupies almost the whole underdoped regime in phase diagrams. A doped metallic AF state undergoes a kind of Lifshitz transition at t' = t'{L} ˜ - 0.05t as t'/t varies, irrespective of the values of U/t and δ (doping rate). Pocket Fermi surfaces arise around (π ,0) [(π /2,π /2)] for t' > t'{L} [t' < t'{L}], which corresponds to the electron-hole asymmetry observed in angle-resolved photoemission spectroscopy (ARPES) spectra. The coexistent state of the two orders is possible basically for t' > t'{L}, because the existence of Fermi surfaces near (π ,0) is a requisite for the electron scattering of {q} = (π ,π ). Actually, the coexistent state appears mainly for t'{L}/t < t'/t ≲ 0.2 in the mixed state. Nevertheless, the AF and coexisting states become unstable toward phase separation for - 0.05 ≲ t'/t ≲ 0.2 but become stable at other values of t'/t owing to the energy reduction by the diagonal hopping of doped holes. We show that this instability does not directly correlate with the strength of d-SC.
3D ordered nanostructures fabricated by nanosphere lithography using an organometallic etch mask
NASA Astrophysics Data System (ADS)
Ling, Xing Yi; Acikgoz, Canet; Phang, In Yee; Hempenius, Mark A.; Reinhoudt, David N.; Vancso, G. Julius; Huskens, Jurriaan
2010-08-01
A new approach for fabricating porous structures on silicon substrates and on polymer surfaces, using colloidal particle arrays with a polymer mask of a highly etch-resistant organometallic polymer, is demonstrated. Monolayers of silica particles, with diameters of 60 nm, 150 nm, 300 nm, or 500 nm, were deposited either on a silicon substrate or on a surface coated with polyethersulfone (PES), and the voids of the arrays were filled with poly(ferrocenylmethylphenylsilane) (PFMPS). Argon ion sputtering removed the excess PFMPS on the particles which enabled removal of the particles with HF. Further pattern transfer steps with reactive ion etching for different time intervals provided structures in silicon or in a PES layer. Free-standing PES membranes exhibiting regular arrays of circular holes with high porosity were fabricated by using cellulose acetate as a sacrificial layer. The pores obtained on silicon substrates after etching were used as molds for nanoimprint lithography (NIL). A combination of the techniques of nanosphere lithography (NSL) and NIL has resulted in 3D nanostructures with a hemispherical shape (inherited from the nanoparticles) which was obtained both in silicon and in PMMA.
Glass-like recovery of antiferromagnetic spin ordering in a photo-excited manganite Pr0.7Ca0.3MnO3
Zhou, S.Y.; Langner, M.C.; Zhu, Y.; Chuang, Y.-D.; Rini, M.; Glover, T.E.; Hertlein, M.P.; Gonzalez, A.G. Cruz; Tahir, N.; Tomioka, Y.; Tokura, Y.; Hussain, Z.; Schoenlein, R.W.
2014-01-16
Electronic orderings of charges, orbitals and spins are observed in many strongly correlated electron materials, and revealing their dynamics is a critical step toward understanding the underlying physics of important emergent phenomena. Here we use time-resolved resonant soft x-ray scattering spectroscopy to probe the dynamics of antiferromagnetic spin ordering in the manganite Pr0:7Ca0:3MnO3 following ultrafast photo-exitation. Our studies reveal a glass-like recovery of the spin ordering and a crossover in the dimensionality of the restoring interaction from quasi-1D at low pump fluence to 3D at high pump fluence. This behavior arises from the metastable state created by photo-excitation, a state characterized by spin disordered metallic droplets within the larger charge- and spin-ordered insulating domains. Comparison with time-resolved resistivity measurements suggests that the collapse of spin ordering is correlated with the insulator-to-metal transition, but the recovery of the insulating phase does not depend on the re-establishment of the spin ordering.
NASA Astrophysics Data System (ADS)
Wu, Ya-Jie; Li, Ning; He, Jing; Kou, Su-Peng
2016-03-01
In this paper, based on mean-field approach and random-phase-approximation, we study the magnetic properties of the repulsive Haldane-Hubbard model on a square lattice. We find antiferromagnetic order driven topological spin density waves beyond Landau’s symmetry-breaking paradigm, for which the effective low energy physics is determined by Chern-Simons-Hopf gauge field theories with different K matrices.
Partridge, Benjamin E; Leowanawat, Pawaret; Aqad, Emad; Imam, Mohammad R; Sun, Hao-Jan; Peterca, Mihai; Heiney, Paul A; Graf, Robert; Spiess, Hans W; Zeng, Xiangbing; Ungar, Goran; Percec, Virgil
2015-04-22
A nonplanar, twisted, and flexible tetrachlorinated perylene bisimide (Cl4PBI) was functionalized with two AB3 minidendrons containing hydrogenated or semifluorinated dodecyl groups. The hydrogenated dendron was attached to the imide groups of Cl4PBI via m = 0, 1, and 2 methylenic units, whereas the dendron containing semifluorinated groups was attached via m = 3 or a di(ethylene oxide) linker (m = 2EO). The supramolecular structures of these compounds, determined by a combination of differential scanning calorimetry, X-ray diffraction, and solid-state NMR, were compared with those of nonchlorinated planar and rigid PBI reported previously, which demonstrated the thermodynamically controlled formation of 2D periodic arrays at high temperatures and 3D arrays at low temperatures. The molecularly less ordered Cl4PBI containing hydrogenated dendrons self-organize into exclusively 3D crystalline periodic arrays under thermodynamic control for m = 0 and 2, while the more highly molecularly ordered PBI produced less stable and ordered 3D crystals and also 2D assemblies. This induction of a higher degree of 3D order in supramolecular assemblies of the less well-ordered molecular building blocks was unanticipated. The semifluorinated dendronized Cl4PBI with m = 3 formed a 2D columnar hexagonal array under kinetic control, whereas the compound with m = 2EO formed an unusual 2D honeycomb-like hexagonal phase under thermodynamic control. These Cl4PBI compounds provide a new route to stable crystalline assemblies via thermodynamic control at lower temperatures than previously obtained with PBI, thus generating 3D order in an accessible range of temperature of interest for structural analysis and for technological applications. PMID:25830346
Study of the structure of 3D-ordered macroporous GaN-ZnS:Mn nanocomposite films
Kurdyukov, D. A. Shishkin, I. I.; Grudinkin, S. A.; Sitnikova, A. A.; Zamoryanskaya, M. V.; Golubev, V. G.
2015-05-15
A film-type 3D-ordered macroporous GaN-ZnS:Mn nanocomposite with the structure of an inverted opal is fabricated. Structural studies of the nanocomposite are performed, and it is shown that GaN and ZnS:Mn introduced into the pores of the silica opal are nanocrystallites misoriented with respect to each other. It is shown that the nanocomposite is a structurally perfect 3D photonic crystal. The efficiency of using a buffer of GaN crystallites to preclude interaction between the surface of the spherical a-SiO{sub 2} particles forming the opal matrix and chemically active substances introduced into the pores is demonstrated.
Moosavifard, Seyyed E; El-Kady, Maher F; Rahmanifar, Mohammad S; Kaner, Richard B; Mousavi, Mir F
2015-03-01
The increasing demand for energy has triggered tremendous research efforts for the development of lightweight and durable energy storage devices. Herein, we report a simple, yet effective, strategy for high-performance supercapacitors by building three-dimensional pseudocapacitive CuO frameworks with highly ordered and interconnected bimodal nanopores, nanosized walls (∼4 nm) and large specific surface area of 149 m(2) g(-1). This interesting electrode structure plays a key role in providing facilitated ion transport, short ion and electron diffusion pathways and more active sites for electrochemical reactions. This electrode demonstrates excellent electrochemical performance with a specific capacitance of 431 F g(-1) (1.51 F cm(-2)) at 3.5 mA cm(-2) and retains over 70% of this capacitance when operated at an ultrafast rate of 70 mA cm(-2). When this highly ordered CuO electrode is assembled in an asymmetric cell with an activated carbon electrode, the as-fabricated device demonstrates remarkable performance with an energy density of 19.7 W h kg(-1), power density of 7 kW kg(-1), and excellent cycle life. This work presents a new platform for high-performance asymmetric supercapacitors for the next generation of portable electronics and electric vehicles. PMID:25671715
NASA Astrophysics Data System (ADS)
Ghosh, Pratyay; Verma, Akhilesh Kumar; Kumar, Brijesh
2016-01-01
A spin-1 Heisenberg model on trimerized kagome lattice is studied by doing a low-energy bosonic theory in terms of plaquette triplons defined on its triangular unit cells. The model considered has an intratriangle antiferromagnetic exchange interaction J (set to 1) and two intertriangle couplings J'>0 (nearest neighbor) and J″ (next nearest neighbor; of both signs). The triplon analysis performed on this model investigates the stability of the trimerized singlet ground state (which is exact in the absence of intertriangle couplings) in the J'-J″ plane. It gives a quantum phase diagram that has two gapless antiferromagnetically ordered phases separated by the spin-gapped trimerized singlet phase. The trimerized singlet ground state is found to be stable on J″=0 line (the nearest-neighbor case), and on both sides of it for J″≠0 , in an extended region bounded by the critical lines of transition to the gapless antiferromagnetic phases. The gapless phase in the negative J″ region has a coplanar 120∘ antiferromagnetic order with √{3 }×√{3 } structure. In this phase, all the magnetic moments are of equal length, and the angle between any two of them on a triangle is exactly 120∘. The magnetic lattice in this case has a unit cell consisting of three triangles. The other gapless phase, in the positive J″ region, is found to exhibit a different coplanar antiferromagnetic order with ordering wave vector q =(0 ,0 ) . Here, two magnetic moments in a triangle are of the same magnitude, but shorter than the third. While the angle between two short moments is 120∘-2 δ , it is 120∘+δ between a short and the long one. Only when J″=J' , their magnitudes become equal and the relative angles 120∘. The magnetic lattice in this q =(0 ,0 ) phase has the translational symmetry of the kagome lattice with triangular unit cells of reduced (isosceles) symmetry. This reduction in the point-group symmetry is found to show up as a difference in the intensities of
High order spatial expansion for the method of characteristics applied to 3-D geometries
Naymeh, L.; Masiello, E.; Sanchez, R.
2013-07-01
The method of characteristics is an efficient and flexible technique to solve the neutron transport equation and has been extensively used in two-dimensional calculations because it permits to deal with complex geometries. However, because of a very fast increase in storage requirements and number of floating operations, its direct application to three-dimensional routine transport calculations it is not still possible. In this work we introduce and analyze several modifications aimed to reduce memory requirements and to diminish the computing burden. We explore high-order spatial approximation, the use of intermediary trajectory-dependent flux expansions and the possibility of dynamic trajectory reconstruction from local tracking for typed subdomains. (authors)
Discussing quantum aspects of higher-derivative 3-D gravity in the first-order formalism
NASA Astrophysics Data System (ADS)
Helayël-Neto, J. A.; de Moraes, L. M.; Vasquez, V. J.
2010-05-01
In this paper, we reassess the issue of deriving the propagators and identifying the spectrum of excitations associated to the vielbein and spin connection of (1+2)-D gravity in the presence of dynamical torsion, while working in the first-order formulation. A number of peculiarities is pointed out whenever the Chern-Simons term is taken into account along with a combination of bilinear terms in the torsion tensor. We present a procedure to derive the full set of propagators, based on an algebra of enlarged spin-type operators, and we discuss under which conditions the poles of the tree-level 2-point functions correspond to physical excitations that do not conflict with causality and unitarity.
A novel high-order, entropy stable, 3D AMR MHD solver with guaranteed positive pressure
NASA Astrophysics Data System (ADS)
Derigs, Dominik; Winters, Andrew R.; Gassner, Gregor J.; Walch, Stefanie
2016-07-01
We describe a high-order numerical magnetohydrodynamics (MHD) solver built upon a novel non-linear entropy stable numerical flux function that supports eight travelling wave solutions. By construction the solver conserves mass, momentum, and energy and is entropy stable. The method is designed to treat the divergence-free constraint on the magnetic field in a similar fashion to a hyperbolic divergence cleaning technique. The solver described herein is especially well-suited for flows involving strong discontinuities. Furthermore, we present a new formulation to guarantee positivity of the pressure. We present the underlying theory and implementation of the new solver into the multi-physics, multi-scale adaptive mesh refinement (AMR) simulation code FLASH (http://flash.uchicago.edu)
A novel high-order, entropy stable, 3D AMR MHD solver with guaranteed positive pressure
NASA Astrophysics Data System (ADS)
Derigs, Dominik; Winters, Andrew R.; Gassner, Gregor J.; Walch, Stefanie
2016-07-01
We describe a high-order numerical magnetohydrodynamics (MHD) solver built upon a novel non-linear entropy stable numerical flux function that supports eight travelling wave solutions. By construction the solver conserves mass, momentum, and energy and is entropy stable. The method is designed to treat the divergence-free constraint on the magnetic field in a similar fashion to a hyperbolic divergence cleaning technique. The solver described herein is especially well-suited for flows involving strong discontinuities. Furthermore, we present a new formulation to guarantee positivity of the pressure. We present the underlying theory and implementation of the new solver into the multi-physics, multi-scale adaptive mesh refinement (AMR) simulation code FLASH (http://flash.uchicago.edu).
Antiferromagnetic order in single crystals of the S =2 quasi-one-dimensional chain MnCl3(bpy)
NASA Astrophysics Data System (ADS)
Shinozaki, Shin-ichi; Okutani, Akira; Yoshizawa, Daichi; Kida, Takanori; Takeuchi, Tetsuya; Yamamoto, Shoji; Risset, Olivia N.; Talham, Daniel R.; Meisel, Mark W.; Hagiwara, Masayuki
2016-01-01
A suite of experimental tools, including high-field magnetization and electron spin resonance (ESR) studies in magnetic fields of up to 50 T and heat capacity studies up to 9 T, have revealed antiferromagnetic order in single crystals of the Heisenberg S =2 chain compound MnCl3(bpy), where bpy is 2 ,2'-bipyridine . The Néel temperature, which depends on the strength of the applied magnetic field and its orientation with respect to the crystalline axes that was revealed by heat capacity measurements, is near 11.5 K in zero field. The spin-flop transition is identified in the magnetization curve acquired at 1.7 K and at μoHSFc=24 T along the c axis. The transition field HSF is lower than that expected from the previous antiferromagnetic resonance (AFMR) studies on a powder sample. The identification of the long-range antiferromagnetic order resolves an earlier report by Granroth et al. [Phys. Rev. Lett. 77, 1616 (1996)], 10.1103/PhysRevLett.77.1616 that identified MnCl3(bpy) as an S =2 Haldane system down to 40 mK. The ESR studies identify a wide range of antiferromagnetic resonance modes that provide additional microscopic information about the g values (ga*=2.09 , gb=1.92 , and gc=2.07 ), the zero-field splitting constants, D /kB=-1.5 K and E /kB=-0.17 K when the nearest-neighbor spin interaction J /kB=31.2 K, which is evaluated from fitting the susceptibility, and the anisotropy of this compound (easy axis is the c axis, the second easy-axis is the b axis, and the hard axis is the a* axis), when using a standard (two-sublattice) AFMR analysis that does not quantitatively reproduce the observed HSFc value. The observed resonance mode indicates the frequency minimum at HSFc.
Propagation of 3D nonlinear waves over complex bathymetry using a High-Order Spectral method
NASA Astrophysics Data System (ADS)
Gouin, Maïté; Ducrozet, Guillaume; Ferrant, Pierre
2016-04-01
Scattering of regular and irregular surface gravity waves propagating over a region of arbitrary three-dimensional varying bathymetry is considered here. The three-dimensional High-Order Spectral method (HOS) with an extension to account for a variable bathymetry is used. The efficiency of the model has been proved to be conserved even with this extension. The method is first applied to a bathymetry consisting of an elliptical lens, as used in the Vincent and Briggs (1989) experiment. Incident waves passing across the lens are transformed and a strong convergence region is observed after the elliptical mound. The wave amplification depends on the incident wave. Numerical results for regular and irregular waves are analysed and compared with other methods and experimental data demonstrating the efficiency and practical applicability of the present approach. Then the method is used to model waves propagating over a real bathymetry: the canyons of Scripps/La Jolla in California. The implementation of this complex bathymetry in the model is presented, as well as the first results achieved. They will be compared to the ones obtained with another numerical model.
NASA Astrophysics Data System (ADS)
Wlasak, M. A.; Cullen, M. J. P.
2014-06-01
A major difference in the formulation of the univariate part of static background error covariance models for use in global operational 4DVAR arises from the order in which the horizontal and vertical transforms are applied. This is because the atmosphere is non-separable with large horizontal scales generally tied to large vertical scales and small horizontal scales tied to small vertical scales. Also horizontal length scales increase dramatically as one enters the stratosphere. A study is presented which evaluates the strengths and weaknesses of each approach with the Met Office Unified Model. It is shown that if the vertical transform is applied as a function of horizontal wavenumber then the horizontal globally-averaged variance and the homogenous, isotropic length scale on each model level for each control variable of the training data is preserved by the covariance model. In addition the wind variance and associated length scales are preserved as the scheme preserves the variances and length scales of horizontal derivatives. If the vertical transform is applied in physical space, it is possible to make it a function of latitude at the cost of not preserving the variances and length scales of the horizontal derivatives. Summer and winter global 4DVAR trials have been run with both background error covariance models. A clear benefit is seen in the fit to observations when the vertical transform is in spectral space and is a function of total horizontal wavenumber.
NASA Astrophysics Data System (ADS)
Nishida, N.; Miyatake, H.; Okuma, S.; Tamegai, T.; Iye, Y.; Yoshizaki, R.; Nishiyama, K.; Nagamine, K.
1988-11-01
We have observed a long-range magnetic ordering (probably an antiferromagnetic one) with a transition temperature above 300 K in Bi 2Sr 2YCu 2O y by the μ +SR method. This is the first observation of the antiferromagnetic ordering with a high Néel temperature in the Bi-Sr-Ca-Cu-O system. The Bi 2Sr 2YCu 2O y may be treated as an analogue of the high- Tc superconductor-rela ted antiferromagnets such as YBa 2Cu 3O 6 or La 2CuO 4-δ.
Vekic, M.; Cannon, J.W.; Scalapino, D.J.; Scalettar, R.T.; Sugar, R.L. Physics Department, Centenary College, 2911 Centenary Boulevard, Shreveport, Louisiana 71104 Department of Physics, University of California, Santa Barbara, California 93106 )
1995-03-20
We study the two-dimensional periodic Anderson model at half filling using quantum Monte Carlo (QMC) techniques. The ground state undergoes a magnetic order-disorder transition as a function of the effective exchange coupling between the conduction and localized bands. Low-lying spin and charge excitations are determined using the maximum entropy method to analytically continue the QMC data. At finite temperature we find a competition between the Kondo effect and antiferromagnetic order which develops in the localized band through Ruderman-Kittel-Kasuya-Yosida interactions.
An itinerant antiferromagnetic metal without magnetic constituents
Svanidze, E.; Wang, Jiakui K.; Besara, T.; Liu, L.; Huang, Q.; Siegrist, T.; Frandsen, B.; Lynn, J. W.; Nevidomskyy, Andriy H.; Gamża, Monika B.; Aronson, M. C.; Uemura, Y. J.; Morosan, E.
2015-07-13
The origin of magnetism in metals has been traditionally discussed in two diametrically opposite limits: itinerant and local moments. Surprisingly, there are very few known examples of materials that are close to the itinerant limit, and their properties are not universally understood. In the case of the two such examples discovered several decades ago, the itinerant ferromagnets ZrZn_{2} and Sc_{3}In, the understanding of their magnetic ground states draws on the existence of 3d electrons subject to strong spin fluctuations. Similarly, in Cr, an elemental itinerant antiferromagnet with a spin density wave ground state, its 3d electron character has been deemed crucial to it being magnetic. Here, we report evidence for an itinerant antiferromagnetic metal with no magnetic constituents: TiAu. Antiferromagnetic order occurs below a Néel temperature of 36 K, about an order of magnitude smaller than in Cr, rendering the spin fluctuations in TiAu more important at low temperatures. In conclusion, this itinerant antiferromagnet challenges the currently limited understanding of weak itinerant antiferromagnetism, while providing insights into the effects of spin fluctuations in itinerant–electron systems.
An itinerant antiferromagnetic metal without magnetic constituents
Svanidze, E.; Wang, Jiakui K.; Besara, T.; Liu, L.; Huang, Q.; Siegrist, T.; Frandsen, B.; Lynn, J. W.; Nevidomskyy, Andriy H.; Gamża, Monika B.; et al
2015-07-13
The origin of magnetism in metals has been traditionally discussed in two diametrically opposite limits: itinerant and local moments. Surprisingly, there are very few known examples of materials that are close to the itinerant limit, and their properties are not universally understood. In the case of the two such examples discovered several decades ago, the itinerant ferromagnets ZrZn2 and Sc3In, the understanding of their magnetic ground states draws on the existence of 3d electrons subject to strong spin fluctuations. Similarly, in Cr, an elemental itinerant antiferromagnet with a spin density wave ground state, its 3d electron character has been deemedmore » crucial to it being magnetic. Here, we report evidence for an itinerant antiferromagnetic metal with no magnetic constituents: TiAu. Antiferromagnetic order occurs below a Néel temperature of 36 K, about an order of magnitude smaller than in Cr, rendering the spin fluctuations in TiAu more important at low temperatures. In conclusion, this itinerant antiferromagnet challenges the currently limited understanding of weak itinerant antiferromagnetism, while providing insights into the effects of spin fluctuations in itinerant–electron systems.« less
An itinerant antiferromagnetic metal without magnetic constituents
Svanidze, E.; Wang, Jiakui K.; Besara, T.; Liu, L.; Huang, Q.; Siegrist, T.; Frandsen, B.; Lynn, J. W.; Nevidomskyy, Andriy H.; Gamża, Monika B.; Aronson, M. C.; Uemura, Y. J.; Morosan, E.
2015-01-01
The origin of magnetism in metals has been traditionally discussed in two diametrically opposite limits: itinerant and local moments. Surprisingly, there are very few known examples of materials that are close to the itinerant limit, and their properties are not universally understood. In the case of the two such examples discovered several decades ago, the itinerant ferromagnets ZrZn2 and Sc3In, the understanding of their magnetic ground states draws on the existence of 3d electrons subject to strong spin fluctuations. Similarly, in Cr, an elemental itinerant antiferromagnet with a spin density wave ground state, its 3d electron character has been deemed crucial to it being magnetic. Here, we report evidence for an itinerant antiferromagnetic metal with no magnetic constituents: TiAu. Antiferromagnetic order occurs below a Néel temperature of 36 K, about an order of magnitude smaller than in Cr, rendering the spin fluctuations in TiAu more important at low temperatures. This itinerant antiferromagnet challenges the currently limited understanding of weak itinerant antiferromagnetism, while providing insights into the effects of spin fluctuations in itinerant–electron systems. PMID:26166042
NASA Astrophysics Data System (ADS)
Coldea, Radu
2008-03-01
We explore the electronic ground state in the orbitally degenerate triangular metallic antiferromagnet AgNiO2. In high-resolution neutron diffraction we observe a structural transition below 365 K to a tripled unit cell in the triangular layers with a periodic arrangement of expanded and contracted NiO6 octahedra, naturally explained by a three-sublattice (√3 x√3) charge order pattern on the triangular lattice of Ni sites. Band-structure calculations suggest that charge order occurs in order to lift the orbital degeneracy and is favoured by the weak electron delocalization over local Jahn Teller distortions found in more insulating systems. An unusual magnetic order is observed at low temperatures with only one third of sites (the electron-rich Ni sites) carrying a magnetic moment arranged in an unexpected collinear stripe order pattern on an antiferromagnetic triangular lattice. Possible mechanisms stabilizing the observed ground state will be discussed. E. Wawrzy'nska, R. Coldea, E.M. Wheeler, I.I. Mazin, M.D. Johannes, T. Sörgel, M. Jansen, R.M. Ibberson, P.G. Radaelli, Phys. Rev. Lett. 99, 157204 (2007). We acknowledge support from EPSRC UK.
NASA Astrophysics Data System (ADS)
Vladimirov, A. A.; Ihle, D.; Plakida, N. M.
2015-02-01
The spin-wave excitation spectrum, magnetization, and Néel temperature for the quasi-two-dimensional spin-1/2 antiferromagnetic Heisenberg model with the compass-model interaction in the plane proposed for iridates are calculated in the random phase approximation. The spin-wave spectrum agrees well with data of Lanczos diagonalization. We find that the Néel temperature is enhanced by the compass-model interaction and is close to the experimental value for Ba2IrO4.
Hardy, Will J; Yuan, Jiangtan; Guo, Hua; Zhou, Panpan; Lou, Jun; Natelson, Douglas
2016-06-28
With materials approaching the 2D limit yielding many exciting systems with intriguing physical properties and promising technological functionalities, understanding and engineering magnetic order in nanoscale, layered materials is generating keen interest. One such material is V5S8, a metal with an antiferromagnetic ground state below the Néel temperature TN ∼ 32 K and a prominent spin-flop signature in the magnetoresistance (MR) when H∥c ∼ 4.2 T. Here we study nanoscale-thickness single crystals of V5S8, focusing on temperatures close to TN and the evolution of material properties in response to systematic reduction in crystal thickness. Transport measurements just below TN reveal magnetic hysteresis that we ascribe to a metamagnetic transition, the first-order magnetic-field-driven breakdown of the ordered state. The reduction of crystal thickness to ∼10 nm coincides with systematic changes in the magnetic response: TN falls, implying that antiferromagnetism is suppressed; and while the spin-flop signature remains, the hysteresis disappears, implying that the metamagnetic transition becomes second order as the thickness approaches the 2D limit. This work demonstrates that single crystals of magnetic materials with nanometer thicknesses are promising systems for future studies of magnetism in reduced dimensionality and quantum phase transitions. PMID:27163511
NASA Astrophysics Data System (ADS)
Li, Jing; Zeng, Zhaofa; Huang, Ling; Liu, Fengshan
2012-12-01
When applying the finite difference time domain (FDTD) method in Ground Penetrating Radar (GPR) simulation, the absorbing boundary conditions (ABC) are used to mitigate undesired reflection that can arise at the model's truncation boundaries. The classical PML boundary can make spurious reflection for the waves, such as reaching to the PML interface with near-grazing angles, low frequency waves or evanescent waves. The non-split complex frequency shifted PML which base on recursive integration (CFS-RIPML) has a good absorption effect for these interference waves. Meanwhile, the recursive integration, which does not need split field component, can overcome the shortcoming of CFS technique that needs more intermediate variable and large memory. In addition, the high-order FDTD can improve calculation accuracy and reduce the error caused by numerical dispersion effectively. In this paper, we derive the 3D high-order FDTD method with CFS-RIPML boundary and apply it in GPR simulation. The results show that the CFS-RIPML has significantly better absorption effect and lower reflections error than UPML and PML boundary. Compared with the two-order, the high-order FDTD can improve calculation accuracy effectively with the same grid size. Combination with CFS-RIPML boundary and high-order FDTD can improve the reliability and calculation accuracy of GPR and other geophysics numerical simulation.
A Novel Large Moment Antiferromagnetic Order in K0.8Fe1.6Se2 Superconductor
NASA Astrophysics Data System (ADS)
Bao, Wei; Huang, Qing-Zhen; Chen, Gen-Fu; A. Green, M.; Wang, Du-Ming; He, Jun-Bao; Qiu, Yi-Ming
2011-08-01
The discovery of cuprate high TC superconductors has inspired the search for unconventional superconductors in magnetic materials. A successful recipe has been to suppress long-range order in a magnetic parent compound by doping or high pressure to drive the material towards a quantum critical point. We report an exception to this rule in the recently discovered potassium iron selenide. The superconducting composition is identified as the iron vacancy ordered K0.83(2)Fe1.64(1)Se2 with TC above 30 K. A novel large moment 3.31 μB/Fe antiferromagnetic order that conforms to the tetragonal crystal symmetry has an unprecedentedly high ordering temperature TN ≈ 559 K for a bulk superconductor. Staggeringly polarized electronic density of states is thus suspected, which would stimulate further investigation into superconductivity in a strong spin-exchange field under new circumstances.
Kallinderis, Yannis; Vitsas, Panagiotis A.; Menounou, Penelope
2012-07-15
A low-order flow/acoustics interaction method for the prediction of sound propagation and diffraction in unsteady subsonic compressible flow using adaptive 3-D hybrid grids is investigated. The total field is decomposed into the flow field described by the Euler equations, and the acoustics part described by the Nonlinear Perturbation Equations. The method is shown capable of predicting monopole sound propagation, while employment of acoustics-guided adapted grid refinement improves the accuracy of capturing the acoustic field. Interaction of sound with solid boundaries is also examined in terms of reflection, and diffraction. Sound propagation through an unsteady flow field is examined using static and dynamic flow/acoustics coupling demonstrating the importance of the latter.
NASA Astrophysics Data System (ADS)
Li, Y.; Han, B.; Métivier, L.; Brossier, R.
2016-09-01
We investigate an optimal fourth-order staggered-grid finite-difference scheme for 3D frequency-domain viscoelastic wave modeling. An anti-lumped mass strategy is incorporated to minimize the numerical dispersion. The optimal finite-difference coefficients and the mass weighting coefficients are obtained by minimizing the misfit between the normalized phase velocities and the unity. An iterative damped least-squares method, the Levenberg-Marquardt algorithm, is utilized for the optimization. Dispersion analysis shows that the optimal fourth-order scheme presents less grid dispersion and anisotropy than the conventional fourth-order scheme with respect to different Poisson's ratios. Moreover, only 3.7 grid-points per minimum shear wavelength are required to keep the error of the group velocities below 1%. The memory cost is then greatly reduced due to a coarser sampling. A parallel iterative method named CARP-CG is used to solve the large ill-conditioned linear system for the frequency-domain modeling. Validations are conducted with respect to both the analytic viscoacoustic and viscoelastic solutions. Compared with the conventional fourth-order scheme, the optimal scheme generates wavefields having smaller error under the same discretization setups. Profiles of the wavefields are presented to confirm better agreement between the optimal results and the analytic solutions.
NASA Astrophysics Data System (ADS)
Moortgat, J.; Firoozabadi, A.
2013-12-01
Most problems of interest in hydrogeology and subsurface energy resources involve complex heterogeneous geological formations. Such domains are most naturally represented in numerical reservoir simulations by unstructured computational grids. Finite element methods are a natural choice to describe fluid flow on unstructured meshes, because the governing equations can be readily discretized for any grid-element geometry. In this work, we consider the challenging problem of fully compositional three-phase flow in 3D unstructured grids, discretized by tetrahedra, prisms, or hexahedra, and compare to simulations on 3D structured grids. We employ a combination of mixed hybrid finite element methods to solve for the pressure and flux fields in a fractional flow formulation, and higher-order discontinuous Galerkin methods for the mass transport equations. These methods are well suited to simulate flow in heterogeneous and fractured reservoirs, because they provide a globally continuous pressure and flux field, while allowing for sharp discontinuities in the phase properties, such as compositions and saturations. The increased accuracy from using higher-order methods improves the modeling of highly non-linear flow, such as gravitational and viscous fingering. We present several numerical examples to study convergence rates and the (lack of) sensitivity to gridding/mesh orientation, and mesh quality. These examples consider gravity depletion, water and gas injection in oil saturated subsurface reservoirs with species exchange between up to three fluid phases. The examples demonstrate the wide applicability of our chosen finite element methods in the study of challenging multiphase flow problems in porous, geometrically complex, subsurface media.
Antiferromagnetic order in a semiconductor quantum well with spin-orbit coupling
NASA Astrophysics Data System (ADS)
Marinescu, D. C.
2015-05-01
An argument is made on the existence of a low-temperature itinerant antiferromagnetic (AF) spin alignment, rather than persistent helical (PH), in the ground state of a two dimensional electron gas in a semiconductor quantum well with linear spin-orbit Rashba-Dresselhaus interaction at equal coupling strengths, α. This result is obtained on account of the opposite-spin single-particle state degeneracy at k = 0 that makes the spin instability possible. A theory of the resulting magnetic phase is formulated within the Hartree-Fock approximation of the Coulomb interaction. In the AF state the direction of the fractional polarization is obtained to be aligned along the displacement vector of the single-particle states.
NASA Astrophysics Data System (ADS)
Fang, F.; Zhang, T.; Pavlidis, D.; Pain, C. C.; Buchan, A. G.; Navon, I. M.
2014-10-01
A novel reduced order model (ROM) based on proper orthogonal decomposition (POD) has been developed for a finite-element (FE) adaptive mesh air pollution model. A quadratic expansion of the non-linear terms is employed to ensure the method remained efficient. This is the first time such an approach has been applied to air pollution LES turbulent simulation through three dimensional landscapes. The novelty of this work also includes POD's application within a FE-LES turbulence model that uses adaptive resolution. The accuracy of the reduced order model is assessed and validated for a range of 2D and 3D urban street canyon flow problems. By comparing the POD solutions against the fine detail solutions obtained from the full FE model it is shown that the accuracy is maintained, where fine details of the air flows are captured, whilst the computational requirements are reduced. In the examples presented below the size of the reduced order models is reduced by factors up to 2400 in comparison to the full FE model while the CPU time is reduced by up to 98% of that required by the full model.
Reduced size of ordered moments of a quasi 1d antiferromagnet Sr{sub 2}CuO{sub 3}
Kojima, K.; Larkin, M.; Luke, G.M.
1996-09-01
The quasi one-dimensional antiferromagnet Sr{sub 2}CuO{sub 3} exhibits Neel order of Cu{sup 2+} moments (S = 1/2) at T{sub N} = 5.41(1) K, as demonstrated by (1) almost resolution-limited magnetic Bragg reflections in neutron scattering measurements, and (2) spontaneous muon spin precession in zero-field muon spin relaxation ({mu}SR) measurements. The temperature dependence of the order parameters are consistent between the two experimental techniques. From the neutron data, the authors obtained an upper-limit for the ordered moment size of {approximately} 0.06 {mu}{sub B}. This indicates a significant moment reduction from quantum fluctuations.
Manson, J. L.; Schlueter, J. A.; McDonald, R. D.; Singleton, J.; Materials Science Division; Eastern Washington Univ.; LANL
2010-04-01
The crystal structure of the title compound was determined by X-ray diffraction at 90 and 295 K. Copper(II) ions are coordinated to four bridging pyz ligands to form square layers in the ab-plane. Bridging HF{sub 2}{sup -} ligands join the layers together along the c-axis to afford a tetragonal, three-dimensional (3D) framework that contains Taf{sub 6}{sup -} anions in every cavity. At 295 K, the pyz rings lie exactly perpendicular to the layers and cooling to 90 K induces a canting of those rings. Magnetically, the compound exhibits 2D antiferromagnetic correlations within the 2D layers with an exchange interaction of -13.1(1) K. Weak interlayer interactions, as mediated by Cu-F-H-F-Cu, leads to long-range magnetic order below 4.2 K. Pulsed-field magnetization data at 0.5 K show a concave curvature with increasing B and reveal a saturation magnetization at 35.4 T.
Long-range antiferromagnetic order in epitaxial Mn2GaC thin films from neutron reflectometry
NASA Astrophysics Data System (ADS)
Ingason, A. S.; Pálsson, G. K.; Dahlqvist, M.; Rosen, J.
2016-07-01
The nature of the magnetic structure in magnetic so-called MAX phases is a topic of some controversy. Here we present unpolarized neutron-diffraction data between 3.4 and 290.0 K and momentum transfer between Q =0.0 and1.1 Å-1, as well as complementary x-ray-diffraction data on epitaxial thin films of the MAX phase material Mn2GaC . This inherently layered material exhibits neutron-diffraction peaks consistent with long-ranged antiferromagnetic order with a periodicity of two structural unit cells. The magnetic structure is present throughout the measured temperature range. The results are in agreement with first-principles calculations of antiferromagnetic structures for this material where the Mn-C-Mn atomic trilayers are found to be ferromagnetically coupled internally but spin flipped or rotated across the Ga layers. The present findings have significant bearing on the discussion regarding the nature of the magnetic structure in magnetic MAX phases.
NASA Astrophysics Data System (ADS)
Wright, G. B.; Barnett, G. A.; Yuen, D. A.
2009-12-01
, 533, 1984. Isosurfaces of the temperature field from a 3-D mantle convection simulation at Rayleigh number 10**7 during the transition from a purely conductive state to a double-layer convection state. Simulation was performed using the compact fourth order finite difference scheme at a resolution of 200-by-200-by-100 (length-by-width-by-height).
Ovchinnikov, S. G. Korshunov, M. M.; Kozeeva, L. P.; Lavrov, A. N.
2010-07-15
We report on the results of measurements of anisotropic resistivity of RBa{sub 2}Cu{sub 3}O{sub 6+x} (R = Tm, Lu) high-temperature superconducting single crystals in a wide range of doping levels, indicating a nontrivial effect of magnetic order on the electronic properties of cuprates. In particular, our results visually demonstrate the crossover from the state with moderate anisotropy of resistivity {rho}{sub c}/{rho}{sub ab} {approx} 30 to a strongly anisotropic state with {rho}{sub c}/{rho}{sub ab} {approx} 7 x 10{sup 3} upon cooling as well as upon a decrease in the hole concentration in the CuO{sub 2} planes. It is also shown that anisotropy is sensitive to the magnetic state of CuO{sub 2} planes and attains its maximum value after the establishment of the long-range antiferromagnetic order. The results are discussed in the framework of the theory based on the t-t'-t''-J model of CuO{sub 2} layers taking into account strong electron correlations and short-range magnetic order. In this theory, anomalies of spin correlators and Fermi surface topology for a critical hole concentration of p* {approx} 0.24 are demonstrated. The concentration dependence of the charge carrier energy indicates partial suppression of energy due to the emergence of a pseudogap at p < p*. This theory explains both the experimentally observed sensitivity of anisotropy in conductivity to the establishment of the antiferromagnetic order and the absence of anomalies in the temperature dependence of resistivity {rho}{sub ab}(T) in the vicinity of the Neel temperature.
Mazzucchi, Gabriel; Caballero-Benitez, Santiago F; Mekhov, Igor B
2016-01-01
Ultracold atomic systems offer a unique tool for understanding behavior of matter in the quantum degenerate regime, promising studies of a vast range of phenomena covering many disciplines from condensed matter to quantum information and particle physics. Coupling these systems to quantized light fields opens further possibilities of observing delicate effects typical of quantum optics in the context of strongly correlated systems. Measurement backaction is one of the most funda- mental manifestations of quantum mechanics and it is at the core of many famous quantum optics experiments. Here we show that quantum backaction of weak measurement can be used for tailoring long-range correlations of ultracold fermions, realizing quantum states with spatial modulations of the density and magnetization, thus overcoming usual requirement for a strong interatomic interactions. We propose detection schemes for implementing antiferromagnetic states and density waves. We demonstrate that such long-range correlations cannot be realized with local addressing, and they are a consequence of the competition between global but spatially structured backaction of weak quantum measurement and unitary dynamics of fermions. PMID:27510369
Mazzucchi, Gabriel; Caballero-Benitez, Santiago F.; Mekhov, Igor B.
2016-01-01
Ultracold atomic systems offer a unique tool for understanding behavior of matter in the quantum degenerate regime, promising studies of a vast range of phenomena covering many disciplines from condensed matter to quantum information and particle physics. Coupling these systems to quantized light fields opens further possibilities of observing delicate effects typical of quantum optics in the context of strongly correlated systems. Measurement backaction is one of the most funda- mental manifestations of quantum mechanics and it is at the core of many famous quantum optics experiments. Here we show that quantum backaction of weak measurement can be used for tailoring long-range correlations of ultracold fermions, realizing quantum states with spatial modulations of the density and magnetization, thus overcoming usual requirement for a strong interatomic interactions. We propose detection schemes for implementing antiferromagnetic states and density waves. We demonstrate that such long-range correlations cannot be realized with local addressing, and they are a consequence of the competition between global but spatially structured backaction of weak quantum measurement and unitary dynamics of fermions. PMID:27510369
NASA Astrophysics Data System (ADS)
Kanellopoulos, V. N.; Webb, J. P.
1993-03-01
A 3D vector analysis of plane wave scattering by a metallic sphere using finite elements and Absorbing Boundary Conditions (ABCs) is presented. The ABCs are applied on the outer surface that truncates the infinitely extending domain. Mixed order curvilinear covariantprojection elements are used to avoid spurious corruptions. The second order ABC is superior to the first at no extra computational cost. The errors due to incomplete absorption decrease as the outer surface is moved further away from the scatterer. An error of about 1% in near-field values was obtained with the second order ABC, when the outer surface was less than half a wavelength from the scatterer. Une analyse tridimensionnelle vectorielle de la diffusion d'onde plane sur une sphère métallique utilisant des éléments finis et des Conditions aux Limites Absorbantes (CLA) est présentée. Les CLA sont appliquées sur la surface exteme tronquant le domaine s'étendant à l'infini. Des éléments curvilignes mixtes utilisant des projections covariantes sont utilisés pour éviter des solutions parasites. La CLA de second ordre est supérieure à celle de premier ordre sans effort de calcul additionnel. Les erreurs dues à l'absorption incomplète décroissent à mesure que l'on déplace la surface externe à une distance croissante du diffuseur. Un taux d'erreur d'environ 1 % dans les valeurs du champ proche a été obtenu avec les CLA de second ordre lorsque la surface externe était placée à une distance inférieure à une demi-longueur de la source de diffusion.
NASA Astrophysics Data System (ADS)
Delorme, Yann; Hassan, Syed Harris; Socha, Jake; Vlachos, Pavlos; Frankel, Steven
2014-11-01
Chrysopelea paradisi are snakes that are able to glide over long distances by morphing the cross section of their bodies from circular to a triangular airfoil, and undulating through the air. Snake glide is characterized by relatively low Reynolds number and high angle of attack as well as three dimensional and unsteady flow. Here we study the 3D dynamics of the flow using an in-house high-order large eddy simulation code. The code features a novel multi block immersed boundary method to accurately and efficiently represent the complex snake geometry. We investigate the steady state 3-dimensionality of the flow, especially the wake flow induced by the presence of the snake's body, as well as the vortex-body interaction thought to be responsible for part of the lift enhancement. Numerical predictions of global lift and drag will be compared to experimental measurements, as well as the lift distribution along the body of the snake due to cross sectional variations. Comparisons with previously published 2D results are made to highlight the importance of 3-dimensional effects. Additional efforts are made to quantify properties of the vortex shedding and Dynamic Mode Decomposition (DMD) is used to analyse the main modes responsible for the lift and drag forces.
NASA Astrophysics Data System (ADS)
Oh, Seongshik
Topological insulator (TI) is one of the rare systems in the history of condensed matter physics that is initiated by theories and followed by experiments. Although this theory-driven advance helped move the field quite fast despite its short history, apparently there exist significant gaps between theories and experiments. Many of these discrepancies originate from the very fact that the worlds readily accessible to theories are often far from the real worlds that are available in experiments. For example, the very paradigm of topological protection of the surface states on Z2 TIs such as Bi2Se3, Bi2Te3, Sb2Te3, etc, is in fact valid only if the sample size is infinite and the crystal momentum is well-defined in all three dimensions. On the other hand, many widely studied forms of TIs such as thin films and nano-wires have significant confinement in one or more of the dimensions with varying level of disorders. In other words, many of the real world topological systems have some important parameters that are not readily captured by theories, and thus it is often questionable how far the topological theories are valid to real systems. Interestingly, it turns out that this very uncertainty of the theories provides additional control knobs that allow us to explore hidden topological territories. In this talk, I will discuss how these additional knobs in thin film topological insulators reveal surprising, at times beautiful, landscapes at the boundaries between order and disorder, 2D and 3D, normal and topological phases. This work is supported by Gordon and Betty Moore Foundation's EPiQS Initiative (GBMF4418).
High-pressure polymorph of LuFe2O4 with room-temperature antiferromagnetic order
NASA Astrophysics Data System (ADS)
Damay, F.; Poienar, M.; Hervieu, M.; Guesdon, A.; Bourgeois, J.; Hansen, T.; Elkaïm, E.; Haines, J.; Hermet, P.; Konczewicz, L.; Hammouda, T.; Rouquette, J.; Martin, C.
2015-06-01
Branded for its potential electronic ferroelectricity, charge-ordered LuF e2O4 has a layered Fe triangular framework, whose topology is a source of degeneracy, both at the charge and spin levels. Here we present an in-depth characterization of LuF e2O4-h p , the high-pressure (h p ) polymorph of LuF e2O4 , using electron, x-ray, and neutron diffraction, combined with transport and magnetization measurements. We show that LuF e2O4-h p is characterized by a misfit-related monoclinic structure, accommodating a buckled triangular [Lu] ∞ layer and two shifted adjacent rectangular [Fe] ∞ planes belonging to a distorted rock salt-type layer. The release of the geometric frustration of the Fe magnetic lattice in the h p form leads to collinear antiferromagnetic ordering at TN=380 K . Possible coexistence of charge and magnetic orders in this material opens research pathways for the design of tunable multifunctional devices using high-pressure techniques.
Kinetic arrest induced antiferromagnetic order in hexagonal FeMnP{sub 0.75}Si{sub 0.25} alloy
Li, Guijiang Li, Wei; Schönecker, Stephan; Li, Xiaoqing; Delczeg-Czirjak, Erna K.; Kvashnin, Yaroslav O.; Eriksson, Olle; Johansson, Börje; Vitos, Levente
2014-12-29
The magnetic state of the FeMnP{sub 0.75}Si{sub 0.25} alloy was investigated by first principles calculations. The coexistence of ferromagnetic and antiferromagnetic phases in FeMnP{sub 0.75}Si{sub 0.25} with the same hexagonal crystal structure was revealed. It was found that kinetic arrest during the transition from the high temperature disordered paramagnetic phase to the low temperature ordered ferromagnetic phase results in the intermediate metastable and partially disordered antiferromagnetic phase. We propose that the ratio of the ferromagnetic and antiferromagnetic phases in the FeMnP{sub 0.75}Si{sub 0.25} sample can be tuned by adjusting the kinetic process of atomic diffusion. The investigations suggest that careful control of the kinetic diffusion process provides another tuning parameter to design candidate magnetocaloric materials.
NASA Astrophysics Data System (ADS)
Fukuoka, Shuhei; Yamashita, Satoshi; Nakazawa, Yasuhiro; Yamamoto, Takashi; Fujiwara, Hideki; Shirahata, Takashi; Takahashi, Kazuko
2016-06-01
The results are presented for systematic heat capacity measurements of π-d interacting systems of κ -(BETS) 2Fe Br4 and κ -(BETS) 2FeC l4 [BETS = bis(ethylenedithio)tetraselenafulvalene] performed under in-plane magnetic fields. We observed sharp thermal anomalies at 2.47 K for κ -(BETS) 2FeB r4 and at 0.47 K for κ -(BETS) 2FeC l4 at 0 T that are associated with antiferromagnetic transitions of the 3 d electrons in the anion layers. From analyses of the magnetic heat capacity data, we indicate that the two compounds show unconventional thermodynamic behaviors inherent in the π-d interacting layered system. In the case of κ -(BETS) 2FeB r4 , a small hump structure was observed in the magnetic heat capacity below the transition temperature when a magnetic field was applied parallel to the a axis. In the case of κ -(BETS) 2FeC l4 , a similar hump structure was observed at 0 T that remained in the data with magnetic fields applied parallel to the a axis. We demonstrate that the temperature dependencies of the magnetic heat capacities scale well by normalizing the temperatures with dominant one-dimensional direct interactions (Jdd/kB) of each compound. The field dependencies of the transition temperatures and the hump structures are elucidated in one simple magnetic field vs temperature (H -T ) phase diagram. These results indicate that the thermodynamic features of both κ-type BETS salts are essentially equivalent, and the observed hump structures are derived from the one-dimensional Jdd interaction characters, which are still influential for magnetic features even in the long-range magnetic ordered states.
Magnetic Order in the Mixed-Spin Triangular Lattice Antiferromagnet NaxMnO2
NASA Astrophysics Data System (ADS)
Chisnell, Robin; Parshall, Dan; Li, Xin; Larson, Amber; Suzuki, Takehito; Checkelsky, Joseph; Rodriguez, Efrain; Lynn, Jeffrey
NaxTMO2 (TM = transition metal) materials consist of alternating layers of Na and TM ions with the TM ions arranged on a geometrically frustrated triangular lattice. Na can be easily and reversibly removed from these materials, making them of interest for application in rechargeable batteries and allowing for exploration of their rich phase diagrams as a function of Na concentration. Na ordering is an important factor in ground state selection, and is driven by electrostatic interactions in many NaxTMO2 systems. The TM = Mn series differs in that Na ordering is driven by a cooperative Jahn-Teller effect, due to the coexistence of Jahn-Teller active Mn3+ and inactive Mn4+ ions. This effect also results in an ordered arrangement of the Mn3+ and Mn4+ ions, and thus of spin-2 and spin-3/2 moments. For x = 5/8, we have recently shown the coexistence of charge and magnetic stripe orderings. Here, we present the results of neutron diffraction measurements performed on single crystal samples of NaxMnO2 and discuss the details of the magnetic structure in the magnetically ordered phase.
NASA Astrophysics Data System (ADS)
Popkov, A. F.; Kulagin, N. E.; Soloviov, S. V.; Sukmanova, K. S.; Gareeva, Z. V.; Zvezdin, A. K.
2015-10-01
The room temperature multiferroic BiFeO3, by far the most studied experimentally, exhibits outstanding ferroelectric properties with a cycloidal magnetic order in the bulk and many unexpected advantages for possible applications in spintronics, sensor techniques, and photovoltaics. To consider ferroelectric and magnetic phase transitions in multiferroic BiFeO3 under electric field, we suggest the Ginsburg-Landau-like approach based on the symmetry and P -ω -L coupling, where the order parameters are: P is the electric polarization, ω is the axial vector of antidistorsion (describing a rotation of the oxygen octahedrons), and L is the antiferromagnetic vector. The theoretical model is consistent with experiment and ab initio calculations data. We give the complete set of numerical coefficients of the model and explore the behavior of P and ω vectors in strong electric field. The proposed approach is particularly promising for the analysis of magnetoelectric phenomena whose length scale is significantly larger than the length of the cell used in ab initio calculations. The considered cycloid problem is the clear example of such a system. Electric field-induced transformations of cycloid are exemplified on an epitaxial BiFeO3 film grown on the (001)-oriented substrate. We show that the jump of vectors P and ω in the field E =6 MV/m is accompanied by a jump of a cycloid spin rotation plane. This effect is of particular interest for spintronics and nanoelectronics.
Effect of Si Substitution on the Antiferromagnetic Ordering in the Kondo Semiconductor CeRu2Al10
NASA Astrophysics Data System (ADS)
Hayashi, Kyosuke; Muro, Yuji; Fukuhara, Tadashi; Kawabata, Jo; Kuwai, Tomohiko; Takabatake, Toshiro
2016-03-01
We have studied the effect of 3p electron doping on the unusual antiferromagnetic (AFM) order in the Kondo semiconductor CeRu2Al10 with TN = 27 K by measuring the magnetic susceptibility χ, specific heat C, and electrical resistivity ρ for polycrystalline samples of CeRu2Al10-ySiy. The large decrease in the absolute value of paramagnetic Curie temperature |θP| with increasing y indicates the suppression of c-f hybridization. The thermal activation behavior in ρ(T) above TN disappears for y ≥ 0.3 and TN decreases to 12 K for y = 0.38. These systematic changes in |θP|, ρ(T), and TN coincide with those reported in the 4d-electron doped system Ce(Ru1-xRhx)2Al10 with respect to the number of doped electrons per formula unit. This coincidence indicates that the Al 3p- and Ru 4d-electrons in CeRu2Al10 play the equivalent role in both the formation of hybridization gap and the unusual AFM ordering.
Raman scattering study on the hidden order and antiferromagnetic phases in URu2-xFexSi2
NASA Astrophysics Data System (ADS)
Kung, Hsiang-Hsi; Ran, Sheng; Kanchanavatee, Noravee; Lee, Alexander; Krapivin, Viktor; Haule, Kristjan; Maple, M. Brian; Blumberg, Girsh
The heavy fermion compound URu2Si2 possesses an unusual ground state known as the ``hidden order'' (HO) phase below T = 17 . 5 K, which evolves into an large moment antiferromagnetic (LMAFM) phase under pressure. A recent Raman scattering study shows that an A2 g symmetry (D4 h) in-gap mode emerges in the HO phase, characterizing the excitation from a chirality density wave. Here, we report Raman scattering results for single crystal URu2-xFexSi2 with x <= 0 . 2 , where the Fe substitution acts as chemical pressure, shifting the system's ground state from HO to LMAFM. We found that the A2 g mode softens with doping, vanishes at the HO and LMAFM phase boundary, then re-emerges and hardens with doping in the LMAFM phase. The relations between the A2 g mode energy and the strength of the HO/LMAFM order parameters will be discussed in this talk. GB and HHK acknowledge support from DOE BES Award DE-SC0005463. AL and VK acknowledge NSF Award DMR-1104884. KH acknowledges NSF Award DMR-1405303. MBM, SR and NK acknowledge DOE BES Award DE-FG02-04ER46105 and NSF Award DMR 1206553.
Investigation of spin ordering in antiferromagnetic Fe1-xMnxPO4 with Mössbauer spectroscopy
NASA Astrophysics Data System (ADS)
Jun Kwon, Woo; Wha Lee, Bo; Sung Kim, Chul
2013-05-01
We have investigated the spin ordering in Fe1-xMnxPO4, which is a possible cathode material for rechargeable lithium ion battery, with antiferromagnetic structure below Néel temperature (TN). The prepared Fe1-xMnxPO4 (x = 0.0, 0.1, and 0.3) samples have orthorhombic structures with space group of Pnma. These samples show the magnetic phase transition, caused by the strong crystalline field at the MO6 octahedral sites. According to the temperature dependence of magnetic susceptibility of Fe1-xMnxPO4, all samples show antiferromagnetic behaviors. The Néel temperature (TN) decreases from 114 K at x = 0.0 to 97 K at x = 0.3 with Mn concentrations. The magnetization of Fe1-xMnxPO4 decreases until the temperature reaches the spin-reorientation (TS) temperature, and then starts increasing as the temperature increases up to TN. The TS of the Fe1-xMnxPO4 were found to be 30, 27, and 24 K for x = 0.0, 0.1, and 0.3. In order to investigate the hyperfine interaction of Fe3+ ions in FeO6 octahedral sites, Mössbauer spectra of Fe1-xMnxPO4 have been taken at various temperatures from 4.2 to 295 K. The isomer shift (δ) values of the Fe1-xMnxPO4 were between 0.31 and 0.43 mm/s, indicating the high spin state of Fe3+ at all temperatures. The magnetic hyperfine field (Hhf) and electric quadrupole splitting (ΔEQ) values of Fe0.9Mn0.1PO4 at 4.2 K were determined to be Hhf = 498 kOe and ΔEQ = 2.1 mm/s. We have also observed the abrupt changes in Hhf and ΔEQ at 27 K for Fe0.9Mn0.1PO4, and decrease the value of TS of Fe1-xMnxPO4 with Mn concentrations. Our study suggests that these changes in Fe1-xMnxPO4 are originated from the strong electric crystalline field and spin-orbit coupling of FeO6 octahedral site.
Magnetic order, magnetic correlations, and spin dynamics in the pyrochlore antiferromagnet Er2Ti2O7
NASA Astrophysics Data System (ADS)
Dalmas de Réotier, P.; Yaouanc, A.; Chapuis, Y.; Curnoe, S. H.; Grenier, B.; Ressouche, E.; Marin, C.; Lago, J.; Baines, C.; Giblin, S. R.
2012-09-01
Er2Ti2O7 is believed to be a realization of an XY antiferromagnet on a frustrated lattice of corner-sharing regular tetrahedra. It is presented as an example of the order-by-disorder mechanism in which fluctuations lift the degeneracy of the ground state, leading to an ordered state. Here we report detailed measurements of the low-temperature magnetic properties of Er2Ti2O7, which displays a second-order phase transition at TN≃1.2 K with coexisting short- and long-range orders. Magnetic susceptibility studies show that there is no spin-glass-like irreversible effect. Heat capacity measurements reveal that the paramagnetic critical exponent is typical of a 3-dimensional XY magnet while the low-temperature specific heat sets an upper limit on the possible spin-gap value and provides an estimate for the spin-wave velocity. Muon spin relaxation measurements show the presence of spin dynamics in the nanosecond time scale down to 21 mK. This time range is intermediate between the shorter time characterizing the spin dynamics in Tb2Sn2O7, which also displays long- and short-range magnetic order, and the time scale typical of conventional magnets. Hence the ground state is characterized by exotic spin dynamics. We determine the parameters of a symmetry-dictated Hamiltonian restricted to the spins in a tetrahedron, by fitting the paramagnetic diffuse neutron scattering intensity for two reciprocal lattice planes. These data are recorded in a temperature region where the assumption that the correlations are limited to nearest neighbors is fair.
Jiang, Hong-Min
2012-09-26
Based on an effective two-orbital tight-binding model, we examine the possible superconducting states in iron-vacancy-ordered A(y)Fe(2-x)Se(2). In the presence of ordered vacancies and blocked antiferromagnetic order, it is shown that the emergent SC pairing is the nodeless next-nearest-neighbor (NNN)-pairing due to the dominant antiferromagnetic (AFM) interaction between the inter-block NNN sites. In particular, we show that due to the ordered vacancies and the associated blocked AFM order, the interplay between the superconducting and AFM states results in three distinct states in the phase diagram as doping is varied. The divergent experimental observations can be accounted for by considering the different charge carrier concentrations in their respective compounds. PMID:22945016
Application of Novel Molecular Field Theory to Helical Antiferromagnetic Ordering in EuCo2P2
NASA Astrophysics Data System (ADS)
Johnston, D. C.; Sangeetha, N. S.
A formulation of Weiss molecular field theory (MFT) was recently advanced for antiferromagnetic (AFM) systems of identical crystallographically-equivalent local moments interacting by Heisenberg exchange that does not utilize the concept of magnetic sublattices.1 This formulation has the attractive feature that the magnetic and thermal properties in magnetic fields H --> 0 depend only on the interactions of a representative spin with its neighbors, and thus allows the properties of collinear and coplanar noncollinear AFM structures to be understood and modeled on the same footing. Neutron diffraction measurements showed that EuCo2P2 with the bct ThCr2Si2 -type structure undergoes an AFM transition to a coplanar noncollinear c-axis helical AFM structure below the ordering temperature TN = 66 . 5 K.2 Here we report the properties and apply our MFT to model the anisotropic magnetic susceptibility of single-crystal EuCo2P2 below TN. Research supported by U.S. Department of Energy, Division of Materials Science and Engineering, under Contract No. DE-AC02-07CH11358.
Impurity induced antiferromagnetic order in Haldane gap compound SrNi2-xMgxV2O8
NASA Astrophysics Data System (ADS)
Pahari, B.; Ghoshray, K.; Ghoshray, A.; Samanta, T.; Das, I.
2007-05-01
The effect of nonmagnetic Mg doping in SrNi2V2O8, a Haldane gap system with a disordered ground state, was investigated using DC magnetic susceptibility and heat capacity measurements in polycrystalline samples of SrNi2-xMgxV2O8 with x=0.03, 0.05, 0.07, 0.1 and 0.14. The results clearly reveal that the substitution of Ni(S=1) ion by Mg(S=0) ion induces a magnetic phase transition with the ordering temperatures lying in the range 3.4-4.3 K, for the samples with lowest and highest value of x. The intrachain exchange constant (J/kB) and the Haldane gap (Δ) for all the compounds were estimated to be ∼98±2 and 25 K, respectively, which are close to that of the undoped compound. The magnetization data further suggest that the compounds exhibit metamagnetic behavior below TN, supporting a picture of antiferromagnet with significant magnetic anisotropy and competing intrachain and interchain interactions.
Quantum Monte Carlo analysis of a charge ordered insulating antiferromagnet: The Ti4O7 Magneli phase
Benali, Anouar; Shulenburger, Luke; Krogel, Jaron T.; Zhong, Xiaoling; Kent, Paul R. C.; Heinonen, Olle
2016-06-07
The Magneli phase Ti4O7 is an important transition metal oxide with a wide range of applications because of its interplay between charge, spin, and lattice degrees of freedom. At low temperatures, it has non-trivial magnetic states very close in energy, driven by electronic exchange and correlation interactions. We have examined three low- lying states, one ferromagnetic and two antiferromagnetic, and calculated their energies as well as Ti spin moment distributions using highly accurate Quantum Monte Carlo methods. We compare our results to those obtained from density functional theory- based methods that include approximate corrections for exchange and correlation. Our resultsmore » confirm the nature of the states and their ordering in energy, as compared with density-functional theory methods. However, the energy differences and spin distributions differ. Here, a detailed analysis suggests that non-local exchange-correlation functionals, in addition to other approximations such as LDA+U to account for correlations, are needed to simultaneously obtain better estimates for spin moments, distributions, energy differences and energy gaps.« less
Benali, Anouar; Shulenburger, Luke; Krogel, Jaron T; Zhong, Xiaoliang; Kent, Paul R C; Heinonen, Olle
2016-07-21
The Magnéli phase Ti4O7 is an important transition metal oxide with a wide range of applications because of its interplay between charge, spin, and lattice degrees of freedom. At low temperatures, it has non-trivial magnetic states very close in energy, driven by electronic exchange and correlation interactions. We have examined three low-lying states, one ferromagnetic and two antiferromagnetic, and calculated their energies as well as Ti spin moment distributions using highly accurate quantum Monte Carlo methods. We compare our results to those obtained from density functional theory-based methods that include approximate corrections for exchange and correlation. Our results confirm the nature of the states and their ordering in energy, as compared with density-functional theory methods. However, the energy differences and spin distributions differ. A detailed analysis suggests that non-local exchange-correlation functionals, in addition to other approximations such as LDA+U to account for correlations, are needed to simultaneously obtain better estimates for spin moments, distributions, energy differences and energy gaps. PMID:27334262
Antiferromagnetic ordering with an anisotropy reversal in USn{sub 0.5}Sb{sub 1.5}
Tran, V.H. . E-mail: V.H.Tran@int.pan.wroc.pl; Bukowski, Z.; Stepien-Damm, J.; Troc, R.
2006-05-15
We report on single crystal growth, crystal structure refinements and on the measurements of low-temperature magnetic properties of a novel uranium intermetallic USn{sub 0.5}Sb{sub 1.5}. Single crystals were grown by means of the antimony flux technique. The crystal structure, refined from single crystal X-ray data, appears to be similar to that of USb{sub 2}, i.e., the tetragonal, anti-Cu{sub 2}Sb type unit cell with space group P4/nmm. Magnetisation and electrical resistivity measurements revealed that this compound orders antiferromagnetically below T{sub N}=177(1)K. A large magnetocrystalline anisotropy observed in the magnetic properties of USn{sub 0.5}Sb{sub 1.5} changes dramatically with decreasing temperature, switching from an easy magnetisation c-axis to an easy ab-plane at 163K. Due to the opening a superzone gap, the electrical resistivity in-plane shows a small hump just below T{sub N} in a manner resembling the formation of spin-density wave or/and charge-density wave.
Lattice distortion and stripelike antiferromagnetic order in Ca10(Pt3As8)(Fe2As2)5
Sapkota, Aashish; Tucker, Gregory S; Ramazanoglu, Mehmet; Tian, Wei; Ni, N; Cava, R J; McQueeney, Robert J; Goldman, Alan I; Kreyssig, Andreas
2014-09-01
Ca10(Pt3As8)(Fe2As2)5 is the parent compound for a class of Fe-based high-temperature superconductors where superconductivity with transition temperatures up to 30 K can be introduced by partial element substitution. We present a combined high-resolution high-energy x-ray diffraction and elastic neutron scattering study on a Ca10(Pt3As8)(Fe2As2)5 single crystal. This study reveals the microscopic nature of two distinct and continuous phase transitions to be very similar to other Fe-based high-temperature superconductors: an orthorhombic distortion of the high-temperature tetragonal Fe-As lattice below TS=110(2) K followed by stripelike antiferromagnetic ordering of the Fe moments below TN=96(2) K. These findings demonstrate that major features of the Fe-based high-temperature superconductors are very robust against variations in chemical constitution as well as structural imperfection of the layers separating the Fe-As layers from each other and confirms that the Fe-As layers primarily determine the physics in this class of material.
Spintronics in antiferromagnets
Soh, Yeong-Ah; Kummamuru, Ravi K.
2012-05-10
Magnetic domains and the walls between are the subject of great interest because of the role they play in determining the electrical properties of ferromagnetic materials and as a means of manipulating electron spin in spintronic devices. However, much less attention has been paid to these effects in antiferromagnets, primarily because there is less awareness of their existence in antiferromagnets, and in addition they are hard to probe since they exhibit no net magnetic moment. In this paper, we discuss the electrical properties of chromium, which is the only elemental antiferromagnet and how they depend on the subtle arrangement of the antiferromagnetically ordered spins. X-ray measurement of the modulation wavevector Q of the incommensurate antiferromagnetic spin-density wave shows thermal hysteresis, with the corresponding wavelength being larger during cooling than during warming. The thermal hysteresis in the Q vector is accompanied with a thermal hysteresis in both the longitudinal and Hall resistivity. During cooling, we measure a larger longitudinal and Hall resistivity compared with when warming, which indicates that a larger wavelength at a given temperature corresponds to a smaller carrier density or equivalently a larger antiferromagnetic ordering parameter compared to a smaller wavelength. This shows that the arrangement of the antiferromagnetic spins directly influences the transport properties. In thin films, the sign of the thermal hysteresis for Q is the same as in thick films, but a distinct aspect is that Q is quantized.
Antiferromagnetic resonance in charge ordering state of Pr 0.5Ca 0.5MnO 3- δ single crystal
NASA Astrophysics Data System (ADS)
Kawamata, S.; Noguchi, S.; Okuda, K.; Nojiri, H.; Motokawa, M.
2001-05-01
An antiferromagnetic resonance (AFMR) is observed in the charge ordered antiferromagnetic phase of Pr 0.5Ca 0.5MnO 3- δ single crystal for the first time. Above the Néel temperature, TN=173 K, a paramagnetic resonance with g=2.0 is observed. There is no significant change of the resonance spectra at the charge ordering transition temperature, TCO=242 K. Below TN, a branch of AFMR is found. Since the resonance field of this mode increases linearly as the frequency is decreased, this branch is assigned as the spin-flop mode. Below 60 K, the critical fields, BC, evaluated as the extrapolation of this mode to zero frequency agree well with the insulator-metal transition fields, BCO, at which the melting of the charge-ordering phase occurs. Present results indicate that the temperature dependence of BCO is affected by the temperature dependence of BC.
Kolesnik, S.; Dabrowski, B.; Chmaissem, O.; Bukowski, Z.; Mais, J.
2001-06-01
We present magnetization and resistivity data on polycrystalline samples of Pr{sub 1{minus}x}Sr{sub x}MnO{sub 3} (0.58{le}x{le}1.00). All the samples are antiferromagnetic insulators at low temperatures. For 0.78{lt}x{lt}0.90, and for x=0.58, both resistivity and magnetization show a clear hysteresis which indicates the first-order nature of the antiferromagnetic transition. Neutron diffraction data show that the paramagnetic-to-antiferromagnetic transition is accompanied by a cubic-to-tetragonal structural transition for 0.78{lt}x{lt}0.90, and tetragonal-to-orthorombic transition for x=0.58. The other samples exhibit continuous transitions to the antiferromagnetic state. Our results show that the structural transitions are the origin of the discontinuous magnetic and resistive transitions. A moderate magnetoresistance effect can be observed for a lower Sr content possibly due to ferromagnetic fluctuations. {copyright} 2001 American Institute of Physics.
Fabris, Daniele; Yu, Eizadora T.
2010-01-01
Chemical probing represents a very versatile alternative for studying the structure and dynamics of substrates that are intractable by established high-resolution techniques. The implementation of MS-based strategies for the characterization of probing products has not only extended the range of applicability to virtually all types of biopolymers, but has also paved the way for the introduction of new reagents that would not have been viable with traditional analytical platforms. As the availability of probing data is steadily increasing on the wings of the development of dedicated interpretation aids, powerful computational approaches have been explored to enable the effective utilization of such information to generate valid molecular models. This combination of factors has contributed to making the possibility of obtaining actual 3D structures by MS-based technologies (MS3D) a reality. Although approaches for achieving structure determination of unknown substrates or assessing the dynamics of known structures may share similar reagents and development trajectories, they clearly involve distinctive experimental strategies, analytical concerns, and interpretation paradigms. This Perspective offers a commentary on methods aimed at obtaining distance constraints for the modeling of full-fledged structures, while highlighting common elements, salient distinctions, and complementary capabilities exhibited by methods employed in dynamics studies. We discuss critical factors to be addressed for completing effective structural determinations and expose possible pitfalls of chemical methods. We survey programs developed for facilitating the interpretation of experimental data and discuss possible computational strategies for translating sparse spatial constraints into all-atom models. Examples are provided to illustrate how the concerted application of very diverse probing techniques can lead to the solution of actual biological substrates. PMID:20648672
NASA Astrophysics Data System (ADS)
Jeong, I.-K.; Hur, N.
2016-07-01
To unravel the origin of the dielectric anomaly at the antiferromagnetic ordering of magnetoelectric Bi2Fe4O9, we performed neutron powder diffraction measurements at temperatures across the Néel temperature, T N. Both local structures and long-range symmetry were studied by using the complementary analyses of atomic pair distribution function (PDF) and Rietveld methods at temperatures of 300 K, 250 K, and 200 K. We found that the PDF peaks that reflected local atomic arrangements exhibited a noticeable variation at temperature below T N without long-range symmetry change. The implication of the PDF evolution is discussed in view of a local structural distortion at the onset of antiferromagnetic ordering.
Bauer, Carl A.; Werner, Gregory R.; Cary, John R.
2011-03-01
A new frequency-domain electromagnetics algorithm is developed for simulating curved interfaces between anisotropic dielectrics embedded in a Yee mesh with second-order error in resonant frequencies. The algorithm is systematically derived using the finite integration formulation of Maxwell's equations on the Yee mesh. Second-order convergence of the error in resonant frequencies is achieved by guaranteeing first-order error on dielectric boundaries and second-order error in bulk (possibly anisotropic) regions. Convergence studies, conducted for an analytically solvable problem and for a photonic crystal of ellipsoids with anisotropic dielectric constant, both show second-order convergence of frequency error; the convergence is sufficiently smooth that Richardson extrapolation yields roughly third-order convergence. The convergence of electric fields near the dielectric interface for the analytic problem is also presented.
Wang, Zhengjun; Seehra, Mohindar S
2016-04-01
Previous magnetic studies in the organic semiconductor β-manganese phthalocyanine (β-MnPc) have reported it to be a canted ferromagnet below T(C) ≈ 8.6 K. However, the recent result of the lack of a λ-type anomaly in the specific heat versus temperature data near the quoted T(C) has questioned the presence of long-range 3-dimensional (3D) magnetic ordering in this system. In this paper, detailed measurements and analysis of the temperature (2 K-300 K) and magnetic field (up to 90 kOe) dependence of the dc and ac magnetic susceptibilities in a powder sample of β-MnPc leads us to conclude that 3D long-range magnetic ordering is absent in this material. This is supported by the Arrott plots and the lack of a peak in the ac susceptibilities, χ' and χ″, near the quoted T(C). Instead, the system can be best described as an Ising-like chain magnet with Arrhenius relaxation of the magnetization governed by an intra-layer ferromagnetic exchange constant J/k(B) = 2.6 K and the single ion anisotropy energy parameter |D|/k(B) = 8.3 K. The absence of 3D long range order is consistent with the measured |D|/ > J. PMID:26954989
NASA Astrophysics Data System (ADS)
Wang, Zhengjun; Seehra, Mohindar S.
2016-04-01
Previous magnetic studies in the organic semiconductor β-manganese phthalocyanine (β-MnPc) have reported it to be a canted ferromagnet below T C ≈ 8.6 K. However, the recent result of the lack of a λ-type anomaly in the specific heat versus temperature data near the quoted T C has questioned the presence of long-range 3-dimensional (3D) magnetic ordering in this system. In this paper, detailed measurements and analysis of the temperature (2 K-300 K) and magnetic field (up to 90 kOe) dependence of the dc and ac magnetic susceptibilities in a powder sample of β-MnPc leads us to conclude that 3D long-range magnetic ordering is absent in this material. This is supported by the Arrott plots and the lack of a peak in the ac susceptibilities, χ‧ and χ″, near the quoted T C. Instead, the system can be best described as an Ising-like chain magnet with Arrhenius relaxation of the magnetization governed by an intra-layer ferromagnetic exchange constant J/k B = 2.6 K and the single ion anisotropy energy parameter |D|/k B = 8.3 K. The absence of 3D long range order is consistent with the measured \\mid D\\mid > J.
NASA Technical Reports Server (NTRS)
Zhang, Jun; Ge, Lixin; Kouatchou, Jules
2000-01-01
A new fourth order compact difference scheme for the three dimensional convection diffusion equation with variable coefficients is presented. The novelty of this new difference scheme is that it Only requires 15 grid points and that it can be decoupled with two colors. The entire computational grid can be updated in two parallel subsweeps with the Gauss-Seidel type iterative method. This is compared with the known 19 point fourth order compact differenCe scheme which requires four colors to decouple the computational grid. Numerical results, with multigrid methods implemented on a shared memory parallel computer, are presented to compare the 15 point and the 19 point fourth order compact schemes.
Order parameter re-mapping algorithm for 3D phase field model of grain growth using FEM
Permann, Cody J.; Tonks, Michael R.; Fromm, Bradley; Gaston, Derek R.
2016-01-14
Phase field modeling (PFM) is a well-known technique for simulating microstructural evolution. To model grain growth using PFM, typically each grain is assigned a unique non-conserved order parameter and each order parameter field is evolved in time. Traditional approaches using a one-to-one mapping of grains to order parameters present a challenge when modeling large numbers of grains due to the computational expense of using many order parameters. This problem is exacerbated when using an implicit finite element method (FEM), as the global matrix size is proportional to the number of order parameters. While previous work has developed methods to reducemore » the number of required variables and thus computational complexity and run time, none of the existing approaches can be applied for an implicit FEM implementation of PFM. Here, we present a modular, dynamic, scalable reassignment algorithm suitable for use in such a system. Polycrystal modeling with grain growth and stress require careful tracking of each grain’s position and orientation which is lost when using a reduced order parameter set. In conclusion, the method presented in this paper maintains a unique ID for each grain even after reassignment, to allow the PFM to be tightly coupled to calculations of the stress throughout the polycrystal. Implementation details and comparative results of our approach are presented.« less
Zhang, Wenchao; Yin, Baoqing; Shen, Ruiqi; Ye, Jiahai; Thomas, Jason A; Chao, Yimin
2013-01-23
A three-dimensionally ordered macroporous Fe(2)O(3)/Al nanothermite membrane has been prepared with a polystyrene spheres template. The nanothermite, with an enhanced interfacial contact between fuel and oxidizer, outputs 2.83 kJ g(-1) of energy. This is significantly more than has been reported before. This approach, fully compatible with MEMS technology, provides an efficient way to produce micrometer thick three-dimensionally ordered nanostructured thermite films with overall spatial uniformity. These exciting achievements will greatly facilitate potential for the future development of applications of nanothermites. PMID:23276147
NASA Astrophysics Data System (ADS)
Zimmerling, Jörn; Wei, Lei; Urbach, Paul; Remis, Rob
2016-03-01
We present a Krylov model-order reduction approach to efficiently compute the spontaneous decay (SD) rate of arbitrarily shaped 3D nanosized resonators. We exploit the symmetry of Maxwell's equations to efficiently construct so-called reduced-order models that approximate the SD rate of a quantum emitter embedded in a resonating nanostructure. The models allow for frequency sweeps, meaning that a single model provides SD rate approximations over an entire spectral interval of interest. Field approximations and dominant quasinormal modes can be determined at low cost as well.
Jittivadhna, Karnyupha; Ruenwongsa, Pintip; Panijpan, Bhinyo
2010-11-01
Textbook illustrations of 3D biopolymers on printed paper, regardless of how detailed and colorful, suffer from its two-dimensionality. For beginners, computer screen display of skeletal models of biopolymers and their animation usually does not provide the at-a-glance 3D perception and details, which can be done by good hand-held models. Here, we report a study on how our students learned more from using our ordered DNA and protein models assembled from colored computer-printouts on transparency film sheets that have useful structural details. Our models (reported in BAMBED 2009), having certain distinguished features, helped our students to grasp various aspects of these biopolymers that they usually find difficult. Quantitative and qualitative learning data from this study are reported. PMID:21567863
Kobayashi, Yuri; Saito, Tsuguyuki; Isogai, Akira
2014-09-22
Aerogels of high porosity and with a large internal surface area exhibit outstanding performances as thermal, acoustic, or electrical insulators. However, most aerogels are mechanically brittle and optically opaque, and the structural and physical properties of aerogels strongly depend on their densities. The unfavorable characteristics of aerogels are intrinsic to their skeletal structures consisting of randomly interconnected spherical nanoparticles. A structurally new type of aerogel with a three-dimensionally ordered nanofiber skeleton of liquid-crystalline nanocellulose (LC-NCell) is now reported. This LC-NCell material is composed of mechanically strong, surface-carboxylated cellulose nanofibers dispersed in a nematic LC order. The LC-NCell aerogels are transparent and combine mechanical toughness and good insulation properties. These properties of the LC-NCell aerogels could also be readily controlled. PMID:24985785
Antiferromagnetic order and Kondo-lattice behavior in single-crystalline Ce2RhSi3
NASA Astrophysics Data System (ADS)
Szlawska, M.; Kaczorowski, D.; Ślebarski, A.; Gulay, L.; Stępień-Damm, J.
2009-04-01
Single crystal of Ce2RhSi3 was investigated by means of x-ray diffraction, magnetization, electrical resistivity, and heat-capacity measurements. Moreover, its electronic structure was studied by cerium core-level x-ray photoemission spectroscopy. The results revealed that Ce2RhSi3 is an antiferromagnetic Kondo lattice due to the presence of stable trivalent Ce ions.
Quantum order in chiral magnets: 3D Non-Fermi Liquid Phase and Blue Quantum Fog in MnSi
NASA Astrophysics Data System (ADS)
Pfleiderer, Christian
2007-03-01
The discovery of a distinct change from Fermi liquid to non-Fermi liquid resistivity and the observation of partial magnetic order in MnSi under high pressure [1,2] has generated great scientific interest in the properties of itinerant-electron systems with weak chiral spin-orbit interactions. Recent theoretical predictions include the spontaneous formation of a skyrmion phase at the boundary of conventional helical order [3] and the existence of a new type of Goldstone-like excitation, so called helimagnons [4]. New experimental work using sophisticated neutron scattering techniques and bulk properties exploring the question of skyrmion textures and helimagnon excitations, as well as studies of the thermal expansion under pressure using a newly developed ultra-high resolution neutron spin-resonance technique (Larmor diffraction) will be reviewed. [1] C. Pfleiderer, S. R. Julian, G. G. Lonzarich, Nature 414, 427 (2001). [2] C. Pfleiderer, et al., Nature 427, 227 (2004). [3] U. R"oßler, A. B. Bogdanov, C. Pfleiderer, Nature 442, 797 (2006). [4] D. Belitz, T. R. Kirkpatrick, A. Rosch, Phys. Rev. B 73, 054431 (2006).
Ozakgul, Kadir
2008-07-08
In this study, it has been presented an algorithm for second-order elastoplastic dynamic time-history analysis of three dimensional frames that have steel members with semirigid joints. The proposed analysis accounts for material, geometric and connection nonlinearities. Material nonlinearity have been modeled by the Ramberg-Osgood relation. While the geometric nonlinearity caused by axial force has been described by the use of the geometric stiffness matrix, the nonlinearity caused by the interaction between the axial force and bending moment has been also described by the use of the stability functions. The independent hardening model has been used to describe the nonlinear behaviour of semi-rigid connections. Dynamic equation of motion has been solved by Newmark's constant acceleration method in time history domain.
Antiferromagnetic hedgehogs with superconducting cores
NASA Astrophysics Data System (ADS)
Goldbart, Paul M.; Sheehy, Daniel E.
1998-09-01
Excitations of the antiferromagnetic state that resemble antiferromagnetic hedgehogs at large distances but are predominantly superconducting inside a core region are discussed within the context of Zhang's SO(5)-symmetry-based approach to the physics of high-temperature superconducting materials. Nonsingular, in contrast with their hedgehog cousins in pure antiferromagnetism, these texture excitations are what hedgehogs become when the antiferromagnetic order parameter is permitted to ``escape'' into superconducting directions. The structure of such excitations is determined in a simple setting, and a number of their experimental implications are examined.
Antiferromagnetic hedgehogs with superconducting cores
Goldbart, P.M.; Sheehy, D.E.
1998-09-01
Excitations of the antiferromagnetic state that resemble antiferromagnetic hedgehogs at large distances but are predominantly superconducting inside a core region are discussed within the context of Zhang{close_quote}s SO(5)-symmetry-based approach to the physics of high-temperature superconducting materials. Nonsingular, in contrast with their hedgehog cousins in pure antiferromagnetism, these texture excitations are what hedgehogs become when the antiferromagnetic order parameter is permitted to {open_quotes}escape{close_quotes} into superconducting directions. The structure of such excitations is determined in a simple setting, and a number of their experimental implications are examined. {copyright} {ital 1998} {ital The American Physical Society}
Ilyushin, A.S.; Kastro, D.A.; Makhmud, I.A.
1986-12-01
Methods of x-ray analysis and nuclear ..gamma..-resonance (Moessbauer effect) have been used to study the distribution of iron and manganese atoms in the intermetallic quaisbinary system Dy(Fe/sub 1-x/Mn/sub x/)/sub 2/, which is isostructural to the Laves phase C15. Ordering of atoms of transition metals has been found in 3d sublattice of intermetallic compounds Dy(Fe/sub 1-x/Mn/sub x/)/sub 2/ with the formation of triple superstructure having the stoichiometric composition Dy(Fe/sub 0 x 25/Mn/sub 0 x 75/)/sub 2/
Magnetic order in a novel 3D oxalate-based coordination polymer {[Cu(bpy)3][Mn2(C2O4)3]·H2O}n.
Jurić, Marijana; Pajić, Damir; Žilić, Dijana; Rakvin, Boris; Molčanov, Krešimir; Popović, Jasminka
2015-12-21
A heterometallic coordination polymer {[Cu(bpy)3][Mn2(C2O4)3]·H2O}n (1; bpy = 2,2'-bipyridine) was synthesized using a building-block approach and characterized by IR spectroscopy, single-crystal X-ray diffraction, magnetization measurement, and X-band ESR spectroscopy both on a single crystal and a polycrystalline sample. The molecular structure of 1 is made of a three-dimensional (3D) anionic network [Mn2(C2O4)3]n(2n-) and tris-chelated cations [Cu(bpy)3](2+) occupying the vacancies of the framework. In compound 1 magnetic order is confirmed below 12.8 K - magnetization measurements reveal an antiferromagnetic-like network of canted Mn(2+) spins with incorporated paramagnetic Cu(2+) centres. The ESR spectroscopy distinctly shows the phase transition; above T≈ 13 K, single isotropic Lorentzian lines of Mn(2+) ions in the high spin state S = 5/2 were observed, while below this temperature, only characteristic Cu(2+) signals from cations were detected. Thermal decomposition residues of 1 at different temperatures (800-1000 °C) were analyzed by powder X-ray diffraction; by heating the sample up to 1000 °C the spinel oxide CuMn2O4 [94.1(2) wt%] was formed. From the refined structural parameters, it could be seen that the obtained spinel is characterized by the inversion parameter δ∼ 0.8, and therefore the structural formula at room temperature can be written as (tet)[Cu0.17Mn0.83](oct)[Mn1.17Cu0.83]O4. PMID:26564382
NASA Astrophysics Data System (ADS)
Tretiakov, Oleg; Barker, Joseph
Skyrmions are topologically protected entities in magnetic materials which have the potential to be used in spintronics for information storage and processing. However, skyrmions in ferromagnets have some intrinsic difficulties which must be overcome to use them for spintronic applications, such as the inability to move straight along current. We show that skyrmions can also be stabilized and manipulated in antiferromagnetic materials. An antiferromagnetic skyrmion is a compound topological object with a similar but of opposite sign spin texture on each sublattice, which e.g. results in a complete cancelation of the Magnus force. We find that the composite nature of antiferromagnetic skyrmions gives rise to different dynamical behavior, both due to an applied current and temperature effects. O.A.T. and J.B. acknowledge support by the Grants-in-Aid for Scientific Research (Nos. 25800184, 25247056, 25220910 and 15H01009) from the Ministry of Education, Culture, Sports, Science and Technology (MEXT) of Japan and SpinNet.
NASA Astrophysics Data System (ADS)
von Rohr, Fabian; Krzton-Maziopa, Anna; Pomjakushin, Vladimir; Grundmann, Henrik; Guguchia, Zurab; Schnick, Wolfgang; Schilling, Andreas
2016-07-01
We report on the magnetic properties of CsCo2Se2 with ThCr2Si2 structure, which we have characterized through a series of magnetization and neutron diffraction measurements. We find that CsCo2Se2 undergoes a phase transition to an antiferromagnetically ordered state with a Néel temperature of {{T}\\text{N}}≈ 66 K. The nearest neighbour interactions are ferromagnetic as observed by the positive Curie–Weiss temperature of \\Theta≈ 51.0 K. We find that the magnetic structure of CsCo2Se2 consists of ferromagnetic sheets, which are stacked antiferromagnetically along the tetragonal c-axis, generally referred to as A-type antiferromagnetic order. The observed magnitude of the ordered magnetic moment at T = 1.5 K is found to be only 0.20(1){μ\\text{Bohr}} / Co. Already in comparably small magnetic fields of {μ0}H{{}\\text{MM}}(5~K)≈ 0.3 T, we observe a metamagnetic transition that can be attributed to spin-rearrangements of CsCo2Se2, with the moments fully ferromagnetically saturated in a magnetic field of {μ0}{{H}\\text{FM}}(5~K)≈ 6.4 T. We discuss the entire experimentally deduced magnetic phase diagram for CsCo2Se2 with respect to its unconventionally weak magnetic coupling. Our study characterizes CsCo2Se2, which is chemically and electronically posed closely to the A x Fe2‑y Se2 superconductors, as a host of versatile magnetic interactions.
von Rohr, Fabian; Krzton-Maziopa, Anna; Pomjakushin, Vladimir; Grundmann, Henrik; Guguchia, Zurab; Schnick, Wolfgang; Schilling, Andreas
2016-07-13
We report on the magnetic properties of CsCo2Se2 with ThCr2Si2 structure, which we have characterized through a series of magnetization and neutron diffraction measurements. We find that CsCo2Se2 undergoes a phase transition to an antiferromagnetically ordered state with a Néel temperature of [Formula: see text] K. The nearest neighbour interactions are ferromagnetic as observed by the positive Curie-Weiss temperature of [Formula: see text] K. We find that the magnetic structure of CsCo2Se2 consists of ferromagnetic sheets, which are stacked antiferromagnetically along the tetragonal c-axis, generally referred to as A-type antiferromagnetic order. The observed magnitude of the ordered magnetic moment at T = 1.5 K is found to be only 0.20(1)[Formula: see text] / Co. Already in comparably small magnetic fields of [Formula: see text] T, we observe a metamagnetic transition that can be attributed to spin-rearrangements of CsCo2Se2, with the moments fully ferromagnetically saturated in a magnetic field of [Formula: see text] T. We discuss the entire experimentally deduced magnetic phase diagram for CsCo2Se2 with respect to its unconventionally weak magnetic coupling. Our study characterizes CsCo2Se2, which is chemically and electronically posed closely to the A x Fe2-y Se2 superconductors, as a host of versatile magnetic interactions. PMID:27195766
Questioning Antiferromagnetic Ordering in the Expanded Metal, Li(NH3)4: A Lack of Evidence from μSR.
Seel, Andrew G; Baker, Peter J; Cottrell, Stephen P; Howard, Christopher A; Skipper, Neal T; Edwards, Peter P
2015-10-01
We present the results of a muon spin relaxation study of the solid phases of the expanded metal, Li(NH3)4. No discernible change in muon depolarization dynamics is witnessed in the lowest temperature phase (≤25 K) of Li(NH3)4, thus suggesting that the prevailing view of antiferromagnetic ordering is incorrect. This is consistent with the most recent neutron diffraction data. Discernible differences in muon behavior are reported for the highest temperature phase of Li(NH3)4 (82-89 K), attributed to the onset of structural dynamics prior to melting. PMID:26722900
Spin frustration and magnetic ordering in triangular lattice antiferromagnet Ca3CoNb2O9
NASA Astrophysics Data System (ADS)
Dai, Jia; Zhou, Ping; Wang, Peng-Shuai; Pang, Fei; Munsie, Tim J.; Luke, Graeme M.; Zhang, Jin-Shan; Yu, Wei-Qiang
2015-12-01
We synthesized a quasi-two-dimensional distorted triangular lattice antiferromagnet Ca3CoNb2O9, in which the effective spin of Co2+ is 1/2 at low temperatures, whose magnetic properties were studied by dc susceptibility and magnetization techniques. The x-ray diffraction confirms the quality of our powder samples. The large Weiss constant θCW˜ -55 K and the low Neel temperature TN˜ 1.45 K give a frustration factor f = | θCW/TN | ≈ 38, suggesting that Ca3CoNb2O9 resides in strong frustration regime. Slightly below TN, deviation between the susceptibility data under zero-field cooling (ZFC) and field cooling (FC) is observed. A new magnetic state with 1/3 of the saturate magnetization Ms is suggested in the magnetization curve at 0.46 K. Our study indicates that Ca3CoNb2O9 is an interesting material to investigate magnetism in triangular lattice antiferromagnets with weak anisotropy. Project supported by the National Natural Science Foundation of China (Grant Nos. 11374364 and 11222433), the National Basic Research Program of China (Grant No. 2011CBA00112). Research at McMaster University supported by the Natural Sciences and Engineering Research Council. Work at North China Electric Power University supported by the Scientific Research Foundation for the Returned Overseas Chinese Scholars, State Education Ministry.
Long-range antiferromagnetic ordering in Cu{sub 2}NiB{sub 2}O{sub 6}
He Zhangzhen . E-mail: he@issp.u-tokyo.ac.jp; Kyomen, Toru; Taniyama, Tomoyasu; Itoh, Mitsuru
2006-12-15
Magnetic properties of peculiar structural type borate Cu{sub 2}NiB{sub 2}O{sub 6} are investigated by means of ac susceptibility, dc magnetization, and heat capacity measurements. This material is isostructural to Cu{sub 2}CoB{sub 2}O{sub 6}, of which the structural configuration is composed of quasi-one-dimensional six-columns ribbons. Our experimental results show that this material displays an antiferromagnetic phase transition at {approx}15 K, which differs from Cu{sub 2}CoB{sub 2}O{sub 6} showing spin-glass behavior below 5 K. The different magnetic ground states in these compounds may be attributed mainly to the subtle balance of the exchange energy in the scalene triangles. - Graphical abstract: Cu{sub 2}NiB{sub 2}O{sub 6} is found to display an antiferromagnetic phase transition at {approx}15 K, which differs from isostructural Cu{sub 2}CoB{sub 2}O{sub 6} showing spin-glass behavior below 5 K. The nature of different magnetic ground states in these compounds can be understood by a non-equilateral triangle model.
Chi, Songxue; Ye, F.; Dai, Pengcheng; Fernandez-Baca, J. A.; Huang, Q.; Lynn, J. W.; Plummer, E. W.; Mathieu, R.; Kaneko, Y.; Tokura, Y.
2007-01-01
We use neutron scattering to study the lattice and magnetic structure of the layered half-doped manganite Pr0.5Ca1.5MnO4. On cooling from high temperature, the system first becomes charge-and orbital-ordered (CO/OO) near TCO = 300 K and then develops checkerboard-like antiferromagnetic (AF) order below TN = 130 K. At temperatures above TN but below TCO (TN
Chi, Songxue; Ye, Feng; Dai, Pengcheng; Fernandez-Baca, Jaime A; Huang, Q.; Lynn, J. W.; Plummer, E Ward; Mathieu, R.; Kaneko, Y.; Tokura, Y.
2007-01-01
We use neutron scattering to study the lattice and magnetic structure of the layered half-doped manganite Pr0.5Ca1.5MnO4. On cooling from high temperature, the system first becomes chargeand orbital-ordered (CO/OO) near TCO = 300 K and then develops checkerboard-like antiferromagnetic (AF) order below TN = 130 K. At temperatures above TN but below TCO (TN
NASA Astrophysics Data System (ADS)
H.-E., M. Musa Saad
2016-07-01
In this study, motivated by observations of the remarkable magnetic insulating nature and high Curie temperature (TC=725 K) of double perovskite oxide Sr2CrOsO6, the electronic, magnetic, and optical characteristics of Sr2CrOsO6 were determined using the full potential linear muffin-tin orbital method according to density functional theory. The spin-orbit coupling contribution was included in the local spin density approximation (LSDA) and generalized gradient approximation (GGA). In addition, the Coulomb repulsion (U) and Hund's exchange (J) energies were considered in both methods (LSDA+U and GGA+U). Full structural optimization confirmed that the ground state of Sr2CrOsO6 is face-centered cubic (Fm-3m symmetry). Calculations predicted that Sr2CrOsO6 is ferrimagnetic half-semiconductive (HSC) due to the vertical hopping of t2g electrons via antiferromagnetic coupling [Cr3+ (t2g3↑)-O (2pπ)-Os5+ (t2g3↓)], which agreed with the experimental results. The HSC energy-gaps originate from the splitting of three partially occupied Os5+ (5d) bands into two fully filled bands and one empty spin-down band. The real ε1 (ω) and imaginary ε2 (ω) parts of the dielectric function ε (ω) and energy-loss spectrum L (ω) were calculated, analyzed, and compared with the electronic results.
Electrical switching of an antiferromagnet
NASA Astrophysics Data System (ADS)
Wadley, P.; Howells, B.; Železný, J.; Andrews, C.; Hills, V.; Campion, R. P.; Novák, V.; Olejník, K.; Maccherozzi, F.; Dhesi, S. S.; Martin, S. Y.; Wagner, T.; Wunderlich, J.; Freimuth, F.; Mokrousov, Y.; Kuneš, J.; Chauhan, J. S.; Grzybowski, M. J.; Rushforth, A. W.; Edmonds, K. W.; Gallagher, B. L.; Jungwirth, T.
2016-02-01
Antiferromagnets are hard to control by external magnetic fields because of the alternating directions of magnetic moments on individual atoms and the resulting zero net magnetization. However, relativistic quantum mechanics allows for generating current-induced internal fields whose sign alternates with the periodicity of the antiferromagnetic lattice. Using these fields, which couple strongly to the antiferromagnetic order, we demonstrate room-temperature electrical switching between stable configurations in antiferromagnetic CuMnAs thin-film devices by applied current with magnitudes of order 106 ampere per square centimeter. Electrical writing is combined in our solid-state memory with electrical readout and the stored magnetic state is insensitive to and produces no external magnetic field perturbations, which illustrates the unique merits of antiferromagnets for spintronics.
Electrical switching of an antiferromagnet.
Wadley, P; Howells, B; Železný, J; Andrews, C; Hills, V; Campion, R P; Novák, V; Olejník, K; Maccherozzi, F; Dhesi, S S; Martin, S Y; Wagner, T; Wunderlich, J; Freimuth, F; Mokrousov, Y; Kuneš, J; Chauhan, J S; Grzybowski, M J; Rushforth, A W; Edmonds, K W; Gallagher, B L; Jungwirth, T
2016-02-01
Antiferromagnets are hard to control by external magnetic fields because of the alternating directions of magnetic moments on individual atoms and the resulting zero net magnetization. However, relativistic quantum mechanics allows for generating current-induced internal fields whose sign alternates with the periodicity of the antiferromagnetic lattice. Using these fields, which couple strongly to the antiferromagnetic order, we demonstrate room-temperature electrical switching between stable configurations in antiferromagnetic CuMnAs thin-film devices by applied current with magnitudes of order 10(6) ampere per square centimeter. Electrical writing is combined in our solid-state memory with electrical readout and the stored magnetic state is insensitive to and produces no external magnetic field perturbations, which illustrates the unique merits of antiferromagnets for spintronics. PMID:26841431
Kim, Hye-Na; Moon, Jun Hyuk
2012-11-01
This paper describes the use of Nb₂O₅-coated TiO₂ 3D ordered porous electrodes in dye-sensitized solar cells. We employed bilayer inverse opal structures as a backbone of 3D porous structures, and the number of Nb₂O₅ coatings was controlled, determining the concentration of Nb₂O₅ coating. XPS measurements confirmed the formation of Nb₂O₅. The uniformity of the Nb₂O₅ coating was characterized by elemental mapping using SEM and TEM measurements. Photovoltaic measurement on dye-sensitized solar cells (DSSCs) that incorporated Nb₂O₅/TiO₂ inverse opal electrodes yielded a maximum efficiency of 7.23% for a 3.3 wt % Nb₂O₅ coating on a TiO₂ IO structure. The Nb₂O₅ significantly increased the short-circuit current density (J(SC)). Electrochemical impedance spectroscopy was used to measure the J(SC), revealing an enhanced electron injection upon deposition of the Nb₂O₅ coating. PMID:23153118
NASA Astrophysics Data System (ADS)
Wu, C.; Chang, T.
2010-12-01
A new method in describing the multifractal characteristics of intermittent events was introduced by Cheng and Wu [Chang T. and Wu C.C., Physical Rev, E77, 045401(R), 2008]. The procedure provides a natural connection between the rank-ordered spectrum and the idea of one-parameter scaling for monofractals. This technique has been demonstrated using results obtained from a 2D MHD simulation. It has also been successfully applied to in-situ solar wind observations [Chang T., Wu, C.C. and Podesta, J., AIP Conf Proc. 1039, 75, 2008], and the broadband electric field oscillations from the auroral zone [Tam, S.W.Y. et al., Physical Rev, E81, 036414, 2010]. We take the next step in this procedure. By using the ROMA spectra and the scaled probability distribution functions (PDFs), raw PDFs can be calculated, which can be compared directly with PDFs from observations or simulation results. In addition to 2D MHD simulation results and in-situ solar wind observation, we show clearly using the ROMA analysis the multifractal character of the 3D fluid simulation data obtained from the JHU turbulence database cluster at http://turbulence.pha.jhu.edu. In particular, we show the scaling of the non-symmetrical PDF for the parallel-velocity fluctuations of this 3D fluid data.
Chi, Songxue; Adroja, D. T.; GUIDI, T.; Bewley, Robert I.; Li, Shiliang; Zhao, Jun; Lynn, J. W.; Brown, C. M.; Qiu, Y.; Chen, G. F,; Luo, J. L.; Wang, N. L.; Dai, Pengcheng
2008-01-01
We use inelastic neutron scattering to study the crystalline electric field (CEF) excitations of Ce{sup 3+} in CeFeAsO{sub 1-x}F{sub x} (x=0, 0.16). For nonsuperconducting CeFeAsO, the Ce CEF levels have three magnetic doublets in the paramagnetic state, but these doublets split into six singlets when the Fe ions order antiferromagnetically. For superconducting CeFeAsO{sub 0.84}F{sub 0.16} (T{sub c} = 41 K), where the static antiferromagnetic order is suppressed, the Ce CEF levels have three magnetic doublets at {h_bar}{sub {omega}} = 0, 18.7, 58.4 meV at all temperatures. Careful measurements of the intrinsic linewidth {Lambda} and the peak position of the 18.7 meV mode reveal a clear anomaly at T{sub c}, consistent with a strong enhancement of local magnetic susceptibility {chi}{double_prime}({h_bar}{sub {omega}}) below T{sub c}. These results suggest that CEF excitations in the rare-earth oxypnictides can be used as a probe of spin dynamics in the nearby FeAs planes.
Zhu, Jian-xin; Dai, Jianhui; Si, Qimiao
2009-01-01
Some of the high {Tc} iron pnictides contain rare-earth elements, raising the question of how the existence and tunability of a d-electron antiferromagnetic order influences the heavy fermion behavior of the f-moments. With CeOFeP and CeOFeAs in mind as prototypes, we derive an extended Anderson lattice model appropriate for these quaternary systems. We show that the Kondo screening of the f-moments are efficiently suppressed by the d-electron ordering. We also argue that, inside the d-electron ordered state (as in CeOFeAs), the f-moments provide a rare realization of a quantum frustrated magnet with competing J{sub 1}-J{sub 2}-J{sub 3} interactions in an effective square lattice. Implications ofr the heavy fermion physics in broader contexts are also discussed.
Ma, Changzheng; Yeo, Tat Soon; Zhao, Yongbo; Feng, Junjie
2014-05-01
In inverse synthetic aperture radar (ISAR) imaging, a target is usually regarded as consist of a few strong (specular) scatterers and the distribution of these strong scatterers is sparse in the imaging volume. In this paper, we propose to incorporate the sparse signal recovery method in 3D multiple-input multiple-output radar imaging algorithm. Sequential order one negative exponential (SOONE) function, which forms homotopy between 1 and 0 norms, is proposed to measure the sparsity. Gradient projection is used to solve a constrained nonconvex SOONE function minimization problem and recover the sparse signal. However, while the gradient projection method is computationally simple, it is not robust when a matrix in the algorithm is ill conditioned. We thus further propose using diagonal loading and singular value decomposition methods to improve the robustness of the algorithm. In order to handle targets with large flat surfaces, a combined amplitude and total-variation objective function is also proposed to regularize the shapes of the flat surfaces. Simulation results show that the proposed gradient projection of SOONE function method is better than orthogonal matching pursuit, CoSaMp, l1-magic, Bayesian method with Laplace prior, smoothed l0 method, and l1-ls in high SNR cases for recovery of ± 1 random spikes sparse signal. The quality of the simulated 3D images and real data ISAR images obtained using the new method is better than that of the conventional correlation method and minimum l2 norm method, and competitive to the aforementioned sparse signal recovery algorithms. PMID:24818240
Collinear order in the frustrated three-dimensional spin-1/2 antiferromagnet Li2CuW2O8
NASA Astrophysics Data System (ADS)
Ranjith, K. M.; Nath, R.; Skoulatos, M.; Keller, L.; Kasinathan, D.; Skourski, Y.; Tsirlin, A. A.
2015-09-01
Magnetic frustration in three dimensions (3D) manifests itself in the spin-1/2 insulator Li2CuW2O8 . Density-functional band-structure calculations reveal a peculiar spin lattice built of triangular planes with frustrated interplane couplings. The saturation field of 29 T contrasts with the susceptibility maximum at 8.5 K and a relatively low Néel temperature TN≃3.9 K . Magnetic order below TN is collinear with the propagation vector (0 ,1/2 ,0 ) and an ordered moment of 0.65(4) μB according to neutron diffraction data. This reduced ordered moment together with the low maximum of the magnetic specific heat (Cmax/R ≃0.35 ) pinpoint strong magnetic frustration in 3D. Collinear magnetic order suggests that quantum fluctuations play a crucial role in this system, where a noncollinear spiral state would be stabilized classically.
Antiferromagnetic and xy ferro-orbital order in insulating SrRuO3 thin films with SrO termination.
Autieri, C
2016-10-26
By means of first-principles calculations we study the structural, magnetic and electronic properties of SrRuO3 surface for the SrO termination. We find that the RuO6 octahedra and the structure of the SrO layers at the surface are strongly modified as well as the Ru-O-Ru bond angles. We find in the thin films a d xy ferro-orbital order. The d xy orbital becomes the lowest in energy as in other quasitwodimensional ruthenates. Such structural rearrangement, together with a band reduction, leads to a modification of the magnetic properties. We compare the Jahn-Teller effect between the ferromagnetic and antiferromagnetic phases. We show that an insulating G-type antiferromagnetic phase takes place in SrRuO3 thin films, substituting the metallic phase experimentally found in every bulk Sr-ruthenates. The single layer SrRuO3 presents many similarities with the Ca2RuO4 low temperature phase, these similarities disappear with a larger number of layers. A study of the ground state of the as function of the number of layers is presented, the competition between bandwidth and Coulomb repulsion determines the ground state. We propose the disorder as responsible for the exchange bias effect observed. PMID:27588503
NASA Astrophysics Data System (ADS)
Ivanov, S. A.; Beran, P.; Bazuev, G. V.; Ericsson, T.; Tellgren, R.; Anil Kumar, P.; Nordblad, P.; Mathieu, R.
2015-03-01
Stoichiometric polycrystalline samples of L n F e2 /3M o1 /3O3(L n =Nd ,Pr ,Ce ,La ) have been prepared by solid-state reaction and studied by means of x-ray and neutron powder diffraction as well as Mössbauer spectroscopy and magnetic measurements. All samples were found to be of single phase and to have Pnma symmetry with valence state +3 of Fe and Mo. It is demonstrated that the B-site cations of L n F e2 /3M o1 /3O3 in accord with L n Fe O3 order in a G-type antiferromagnetic structure with the magnetic moments aligned along the b axis. However, with significantly lower Néel temperatures than their L n Fe O3 parent compounds. The Fe-O-Fe bond lengths and bond angles and thus the magnitude of the antiferromagnetic superexchange interaction are found to systematically change with the ionic radius of Ln such that TN increases with increasing radius. Only the CeF e2 /3M o1 /3O3 compound experiences a low temperature spin reorientation from alignment along the b axis to the a axis.
NASA Astrophysics Data System (ADS)
Tobey, R. I.; Wall, S.; Först, M.; Bromberger, H.; Khanna, V.; Turner, J. J.; Schlotter, W.; Trigo, M.; Krupin, O.; Lee, W. S.; Chuang, Y. D.; Moore, R.; Cavalieri, A. L.; Wilkins, S. B.; Zeng, H.; Mitchell, J. F.; Dhesi, S. S.; Cavalleri, A.; Hill, J. P.
2013-03-01
Time-resolved x-ray diffraction measures the dynamics of antiferromagnetic correlations by reconstructing the reciprocal-space scattering volume for the magnetic Bragg peak. Modifications in the scattering line shape along the three principal reciprocal lattice directions are measured.
NASA Astrophysics Data System (ADS)
Iizuka, Keigo
2008-02-01
In order to circumvent the fact that only one observer can view the image from a stereoscopic microscope, an attachment was devised for displaying the 3D microscopic image on a large LCD monitor for viewing by multiple observers in real time. The principle of operation, design, fabrication, and performance are presented, along with tolerance measurements relating to the properties of the cellophane half-wave plate used in the design.
Antiferromagnetic order competing with topological state in Ce{sub x}Bi{sub 2−x}Te{sub 3}
Lee, H. S.; Kim, J.; Jung, M. H.; Lee, K.; Jelen, A.; Vrtnik, S.; Jagličić, Z.; Dolinšek, J.
2015-11-02
The topological surface states in three-dimensional topological insulators are easily tuned by chemical doping, especially by magnetic impurities. We prepared single crystals of Ce{sub x}Bi{sub 2−x}Te{sub 3} with various x (=0.04, 0.06, 0.08, 0.10, and 0.12). The obtained crystals were characterized by X-ray diffraction and scanning electron microscopy. The magnetic susceptibility data revealed that the Ce atoms are well substituted for Bi into Bi{sub 2}Te{sub 3}. From the Curie-Weiss fits, we observed that the effective magnetic moments μ{sub eff} are close to 2.54 μ{sub B} for free Ce ion, and the paramagnetic Curie-Weiss temperatures θ{sub p} are negatively increased from 2.87 K to −59.3 K with increasing x. The magnetization data clearly showed antiferromagnetic orders around T{sub N} = 4.1 K for x ≥ 0.08, where θ{sub p} suddenly increases, and the electrical resistivity is simply metallic and the magnetoresistance is parabolic. Only for x = 0.06, exotic physical properties arising from the topological states were observed such as non-metallic behavior in the electrical resistivity and linear dependence of the magnetoresistance. Moreover, the carrier concentration of x = 0.06 is one order lower than that of x ≥ 0.08. These observations propose that the antiferromagnetic order is strongly competing with the topological state in Ce{sub x}Bi{sub 2−x}Te{sub 3}.
NASA Astrophysics Data System (ADS)
Marino, Eduardo C.; Silva Neto, Marcello B.
2001-09-01
We study the destruction of long-range antiferromagnetic order in the high-Tc superconductors La2-xSrxCuO4 and YBa2Cu3O6+x. The CP1-nonlinear sigma model formulation of the two-dimensional quantum Heisenberg antiferromagnet is used for describing the pure system. Dopants are introduced as independent fermions with an appropriate dispersion relation determined by the shape of the Fermi surface. Skyrmion topological defects are shown to be introduced by doping and their energy is used as an order parameter for the antiferromagnetic order. We obtain analytic expressions for the skyrmion energy as a function of doping that allow us to plot, without adjustable parameters, the curves TN(xc)×xc and M(x)×x, for the two compounds, in good quantitative agreement with the experimental data.
NASA Astrophysics Data System (ADS)
Tirupathi, S.; Schiemenz, A. R.; Liang, Y.; Parmentier, E.; Hesthaven, J.
2013-12-01
The style and mode of melt migration in the mantle are important to the interpretation of basalts erupted on the surface. Both grain-scale diffuse porous flow and channelized melt migration have been proposed. To better understand the mechanisms and consequences of melt migration in a heterogeneous mantle, we have undertaken a numerical study of reactive dissolution in an upwelling and viscously deformable mantle where solubility of pyroxene increases upwards. Our setup is similar to that described in [1], except we use a larger domain size in 2D and 3D and a new numerical method. To enable efficient simulations in 3D through parallel computing, we developed a high-order accurate numerical method for the magma dynamics problem using discontinuous Galerkin methods and constructed the problem using the numerical library deal.II [2]. Linear stability analyses of the reactive dissolution problem reveal three dynamically distinct regimes [3] and the simulations reported in this study were run in the stable regime and the unstable wave regime where small perturbations in porosity grows periodically. The wave regime is more relevant to melt migration beneath the mid-ocean ridges but computationally more challenging. Extending the 2D simulations in the stable regime in [1] to 3D using various combinations of sustained perturbations in porosity at the base of the upwelling column (which may result from a viened mantle), we show the geometry and distribution of dunite channel and high-porosity melt channels are highly correlated with inflow perturbation through superposition. Strong nonlinear interactions among compaction, dissolution, and upwelling give rise to porosity waves and high-porosity melt channels in the wave regime. These compaction-dissolution waves have well organized but time-dependent structures in the lower part of the simulation domain. High-porosity melt channels nucleate along nodal lines of the porosity waves, growing downwards. The wavelength scales
Guo, Y. M.; Ruan, M. Y.; Cheng, J. J.; Sun, Y. C.; Ouyang, Z. W. Xia, Z. C.; Rao, G. H.
2015-06-14
High-field electron spin resonance (ESR) has been employed to study the antiferromagnetic (AFM) ordering state (T < T{sub N} = 55 K) of spin-chain multiferroic Gd{sub 2}BaNiO{sub 5}. The spin reorientation at T{sub SR} = 24 K is well characterized by the temperature-dependent ESR spectra. The magnetization data evidence a field-induced spin-flop transition at 2 K. The frequency-field relationship of the ESR data can be explained by conventional AFM resonance theory with uniaxial anisotropy, in good agreement with magnetization data. Related discussion on zero-field spin gap is presented.
ERIC Educational Resources Information Center
Jittivadhna, Karnyupha; Ruenwongsa, Pintip; Panijpan, Bhinyo
2010-01-01
Textbook illustrations of 3D biopolymers on printed paper, regardless of how detailed and colorful, suffer from its two-dimensionality. For beginners, computer screen display of skeletal models of biopolymers and their animation usually does not provide the at-a-glance 3D perception and details, which can be done by good hand-held models. Here, we…
NASA Astrophysics Data System (ADS)
Wang, Shuai; Wang, Yu; Zi, Yanyang; He, Zhengjia
2015-12-01
A generalized and efficient model for rotating anisotropic rotor-bearing systems is presented in this paper with full considerations of the system's anisotropy in stiffness, inertia and damping. Based on the 3D finite element model and the model order reduction method, the effects of anisotropy in shaft and bearings on the forced response and whirling of anisotropic rotor-bearing systems are systematically investigated. First, the coefficients of journal bearings are transformed from the fixed frame to the rotating one. Due to the anisotropy in shaft and bearings, the motion is governed by differential equations with periodically time-variant coefficients. Then, a free-interface complex component mode synthesis (CMS) method is employed to generate efficient reduced-order models (ROM) for the periodically time-variant systems. In order to solve the obtained equations, a variant of Hill's method for systems with multiple harmonic excitations is developed. Four dimensionless parameters are defined to quantify the types and levels of anisotropy of bearings. Finally, the effects of the four types of anisotropy on the forced response and whirl orbits are studied. Numerical results show that the anisotropy of bearings in stiffness splits the sole resonant peak into two isolated ones, but the anisotropy of bearings in damping coefficients mainly affect the response amplitudes. Moreover, the whirl orbits become much more complex when the shaft and bearings are both anisotropic. In addition, the cross-coupling stiffness coefficients of bearings significantly affect the dynamic behaviors of the systems and cannot be neglected, though they are often much smaller than the principle stiffness terms.
NASA Astrophysics Data System (ADS)
Li, P. H. Y.; Bishop, R. F.; Campbell, C. E.
2015-01-01
We use the coupled cluster method (CCM) to study the zero-temperature ground-state (GS) properties of a spin-1/2 J1-J2 Heisenberg antiferromagnet on a triangular lattice with competing nearest-neighbor and next-nearest-neighbor exchange couplings J1>0 and J2≡κ J1>0 , respectively, in the window 0 ≤κ <1 . The classical version of the model has a single GS phase transition at κcl=1/8 in this window from a phase with 3-sublattice antiferromagnetic (AFM) 120∘ Néel order for κ <κcl to an infinitely degenerate family of 4-sublattice AFM Néel phases for κ >κcl . This classical accidental degeneracy is lifted by quantum fluctuations, which favor a 2-sublattice AFM striped phase. For the quantum model we work directly in the thermodynamic limit of an infinite number of spins, with no consequent need for any finite-size scaling analysis of our results. We perform high-order CCM calculations within a well-controlled hierarchy of approximations, which we show how to extrapolate to the exact limit. In this way we find results for the case κ =0 of the spin-1/2 model for the GS energy per spin, E /N =-0.5521 (2 ) J1 , and the GS magnetic order parameter, M =0.198 (5 ) (in units where the classical value is Mcl=1/2), which are among the best available. For the spin-1/2 J1-J2 model we find that the classical transition at κ =κcl is split into two quantum phase transitions at κ1c=0.060 (10 ) and κ2c=0.165 (5 ) . The two quasiclassical AFM states (viz., the 120∘ Néel state and the striped state) are found to be the stable GS phases in the regime κ <κ1c and κ >κ2c , respectively, while in the intermediate regimes κ1c<κ <κ2c the stable GS phase has no evident long-range magnetic order.
NASA Astrophysics Data System (ADS)
Tóth, Krisztina; Kovács, Gábor
2014-05-01
Geoelectrical imaging is one of the most common survey methods in the field of shallow geophysics. In order to get information from the subsurface electric current is induced into the ground. In our summer camp organized by the Department of Geophysics and Space Sciences, Eötvös Loránd University we have carried out resistivity surveys to get more accurate information about the lithology of the Dorog basin located in the Transdanubian range, Middle Hungary. This study focused on the outcropping limestone block located next to the village Leányvár in the Dorog basin. The main aim of the research is the impoundment of the subsurface continuation of the limestone outcrop. Cable problems occurred during field survey therefore the dataset obtained by the measurement have become very noisy thus we had to gain smoothed data with the appropriate editing steps. The goal was to produce an optimized model to demonstrate the reality beneath the subsurface. In order to achieve better results from the noisy dataset we changed some parameters based on the description of the program. Whereas cable problems occurred we exterminated the bad datum points visually and statistically as well. Because of the noisiness we increased the value of the so called damping factor which is a variable parameter in the equation used by the inversion routine responsible for smoothing the data. The limitation of the range of model resistivity values based on our knowledge about geological environment was also necessary in order to avoid physically unrealistic results. The purpose of the modification was to obtain smoothed and more interpretable geoelectric profiles. The geological background combined with the explanation of the profiles gave us the approximate location of the block. In the final step of the research we created a 3D model with proper location and smoothed resistivity data included. This study was supported by the Hungarian Scientific Research Fund (OTKA NK83400) and was realized
NASA Astrophysics Data System (ADS)
Pletinckx, D.
2011-09-01
The current 3D hype creates a lot of interest in 3D. People go to 3D movies, but are we ready to use 3D in our homes, in our offices, in our communication? Are we ready to deliver real 3D to a general public and use interactive 3D in a meaningful way to enjoy, learn, communicate? The CARARE project is realising this for the moment in the domain of monuments and archaeology, so that real 3D of archaeological sites and European monuments will be available to the general public by 2012. There are several aspects to this endeavour. First of all is the technical aspect of flawlessly delivering 3D content over all platforms and operating systems, without installing software. We have currently a working solution in PDF, but HTML5 will probably be the future. Secondly, there is still little knowledge on how to create 3D learning objects, 3D tourist information or 3D scholarly communication. We are still in a prototype phase when it comes to integrate 3D objects in physical or virtual museums. Nevertheless, Europeana has a tremendous potential as a multi-facetted virtual museum. Finally, 3D has a large potential to act as a hub of information, linking to related 2D imagery, texts, video, sound. We describe how to create such rich, explorable 3D objects that can be used intuitively by the generic Europeana user and what metadata is needed to support the semantic linking.
Lancaster, T.; Blundell, S. J.; Brooks, M. L.; Baker, P. J.; Pratt, F. L.; Manson, J. L.; Connor, M. M.; Xiao, F.; Landee, C. P.; Chaves, F. A.; Soriano, S.; Novak, M. A.; Papageorgiou, T.; Bianchi, A.; Wosnitza, J.; Schlueter, J. A.; Materials Science Division; Oxford Univ.; Rutherford Appleton Lab.; Eastern Washington Univ.; Clark Univ.; Inst. de Fisica, UFRJ; Hochfeld-Magnetlabor Dresden
2007-01-01
We present an investigation of magnetic ordering in the two-dimensional S=1/2 quantum magnet Cu(Pz){sub 2}(ClO{sub 4}){sub 2} using specific heat and zero-field muon-spin relaxation ({mu}{sup +}SR). The magnetic contribution to the specific heat is consistent with an exchange strength of 17.7(3) K. We find unambiguous evidence for a transition to a state of three-dimensional long-range order below a critical temperature T{sub N} = 4.21(1) K using {mu}{sup +} SR even though there is no feature in the specific heat at that temperature. The absence of a specific heat anomaly at T{sub N} is consistent with recent theoretical predictions. The ratio of T{sub N}/J=0.24 corresponds to a ratio of intralayer to interlayer exchange constants of |J{prime}/J| = 6.8 x 10{sup -4}, indicative of excellent two-dimensional isolation. The scaled magnetic specific heat of [Cu(Pz){sub 2}(HF{sub 2})]BF{sub 4}, a compound with an analogous structure, is very similar to that of Cu(Pz){sub 2}(ClO{sub 4}){sub 2} although both differ slightly from the predicted value for an ideal 2D S=1/2 Heisenberg antiferromagnet.
NASA Astrophysics Data System (ADS)
Hague, J. P.; Chung, E. M. L.; Visser, D.; Balakrishnan, G.; Clementyev, E.; Paul, D. MK; Lees, M. R.
2005-11-01
We describe neutron inelastic scattering measurements of spin waves in the quasi-two-dimensional antiferromagnet FeTa2O6. The intrinsic spin wave dispersion for a single domain is deduced from linear spin wave theory and used to determine the intra-plane exchange coefficients. Almost dispersion-free excitations are observed along the c* direction perpendicular to the magnetic planes. This justifies the neglect of inter-plane coupling, which merely stabilizes the ordered configuration below TN. Spin wave theory yields values for the nearest neighbour and next nearest neighbour exchange constants on perpendicular diagonals of J = -0.040(9) meV, J'/J = 0.20(0), J''/J = 0.23(9), and the anisotropy parameter D = 0.31(8) meV. The large value of D shows an Ising-like spin configuration to be consistent with the experimental data. Measurements of the temperature dependence of the scattering show that magnetic excitations persist to at least 20 K (over two times TN) due to the extensive 2D short range order. This is a highly unusual result, and has consequences for the understanding of two-dimensional spin systems.
NASA Astrophysics Data System (ADS)
Kumar, Manoranjan; Soos, Z. G.
2013-10-01
The quantum phases of one-dimensional spin s=1/2 chains are discussed for models with two parameters, frustrating exchange g=J2>0 between second neighbors and normalized nonfrustrating power-law exchange with exponent α and distance dependence r-α. The ground state (GS) at g=0 has a long-range order (LRO) for α<2 and long-range spin fluctuations for α>2. The models conserve total spin S=SA+SB, have singlet GS for any g, α≥0 and decouple at 1/g=0 to linear Heisenberg antiferromagnets on sublattices A and B of odd- and even-numbered sites. Exact diagonalization of finite chains gives the sublattice spin
Chang, Y. C.; Duh, J. G. E-mail: lin.yg@nsrrc.org.tw; Hsiao, S. N. E-mail: lin.yg@nsrrc.org.tw; Liu, S. H.; Su, S. H.; Chiu, K. F.; Hsieh, W. C.; Chen, S. K.; Lin, Y. G. E-mail: lin.yg@nsrrc.org.tw; Lee, H. Y.; Sung, C. K.
2015-05-07
Two series of samples of single-layer IrMn and IrMn/FePd bilayer films, deposited on a single-crystal MgO substrate at different IrMn deposition temperatures (T{sub s} = 300–700 °C), were investigated using magnetron sputtering. L1{sub 2} ordering was revealed for the 30 nm-thick IrMn epitaxial (001) films with T{sub s} ≥ 400 °C, determined by synchrotron radiation x-ray diffractometry (XRD). XRD results also provide evidence of the epitaxial growth of the IrMn films on MgO substrate. Increasing T{sub s} from 400 to 700 °C monotonically increases the ordering parameter of L1{sub 2} phases from 0.17 to 0.81. An in-plane exchange bias field (H{sub eb}) of 22 Oe is obtained in a 10 nm-thick FePd film that is deposited on the disordered IrMn films. As the L1{sub 2} ordering of the IrMn layers increases, the H{sub eb} gradually decreases to 0 Oe, meaning that the exchange bias behavior vanishes. The increased surface roughness, revealed by atomic force microscopy, of the epitaxial IrMn layers with increasing T{sub s} cannot be the main cause of the decrease in H{sub eb} due to the compensated surface spins regardless of the disordered and ordered (001) IrMn layers. The change of antiferromagnetic structure from the A1 to the L1{sub 2} phase was correlated with the evolution of H{sub eb}.
NASA Astrophysics Data System (ADS)
Tyagi, Pawan; Baker, Collin; D'Angelo, Christopher
2015-07-01
This paper reports our Monte Carlo (MC) studies aiming to explain the experimentally observed paramagnetic molecule induced antiferromagnetic coupling between ferromagnetic (FM) electrodes. Recently developed magnetic tunnel junction based molecular spintronics devices (MTJMSDs) were prepared by chemically bonding the paramagnetic molecules between the FM electrodes along the tunnel junction’s perimeter. These MTJMSDs exhibited molecule-induced strong antiferromagnetic coupling. We simulated the 3D atomic model analogous to the MTJMSD and studied the effect of molecule’s magnetic couplings with the two FM electrodes. Simulations show that when a molecule established ferromagnetic coupling with one electrode and antiferromagnetic coupling with the other electrode, then theoretical results effectively explained the experimental findings. Our studies suggest that in order to align MTJMSDs’ electrodes antiparallel to each other, the exchange coupling strength between a molecule and FM electrodes should be ˜50% of the interatomic exchange coupling for the FM electrodes.
Tyagi, Pawan; Baker, Collin; D'Angelo, Christopher
2015-07-31
This paper reports our Monte Carlo (MC) studies aiming to explain the experimentally observed paramagnetic molecule induced antiferromagnetic coupling between ferromagnetic (FM) electrodes. Recently developed magnetic tunnel junction based molecular spintronics devices (MTJMSDs) were prepared by chemically bonding the paramagnetic molecules between the FM electrodes along the tunnel junction's perimeter. These MTJMSDs exhibited molecule-induced strong antiferromagnetic coupling. We simulated the 3D atomic model analogous to the MTJMSD and studied the effect of molecule's magnetic couplings with the two FM electrodes. Simulations show that when a molecule established ferromagnetic coupling with one electrode and antiferromagnetic coupling with the other electrode, then theoretical results effectively explained the experimental findings. Our studies suggest that in order to align MTJMSDs' electrodes antiparallel to each other, the exchange coupling strength between a molecule and FM electrodes should be ∼50% of the interatomic exchange coupling for the FM electrodes. PMID:26159362
PLOT3D/AMES, APOLLO UNIX VERSION USING GMR3D (WITH TURB3D)
NASA Technical Reports Server (NTRS)
Buning, P.
1994-01-01
five groups: 1) Grid Functions for grids, grid-checking, etc.; 2) Scalar Functions for contour or carpet plots of density, pressure, temperature, Mach number, vorticity magnitude, helicity, etc.; 3) Vector Functions for vector plots of velocity, vorticity, momentum, and density gradient, etc.; 4) Particle Trace Functions for rake-like plots of particle flow or vortex lines; and 5) Shock locations based on pressure gradient. TURB3D is a modification of PLOT3D which is used for viewing CFD simulations of incompressible turbulent flow. Input flow data consists of pressure, velocity and vorticity. Typical quantities to plot include local fluctuations in flow quantities and turbulent production terms, plotted in physical or wall units. PLOT3D/TURB3D includes both TURB3D and PLOT3D because the operation of TURB3D is identical to PLOT3D, and there is no additional sample data or printed documentation for TURB3D. Graphical capabilities of PLOT3D version 3.6b+ vary among the implementations available through COSMIC. Customers are encouraged to purchase and carefully review the PLOT3D manual before ordering the program for a specific computer and graphics library. There is only one manual for use with all implementations of PLOT3D, and although this manual generally assumes that the Silicon Graphics Iris implementation is being used, informative comments concerning other implementations appear throughout the text. With all implementations, the visual representation of the object and flow field created by PLOT3D consists of points, lines, and polygons. Points can be represented with dots or symbols, color can be used to denote data values, and perspective is used to show depth. Differences among implementations impact the program's ability to use graphical features that are based on 3D polygons, the user's ability to manipulate the graphical displays, and the user's ability to obtain alternate forms of output. The Apollo implementation of PLOT3D uses some of the capabilities of
PLOT3D/AMES, APOLLO UNIX VERSION USING GMR3D (WITHOUT TURB3D)
NASA Technical Reports Server (NTRS)
Buning, P.
1994-01-01
five groups: 1) Grid Functions for grids, grid-checking, etc.; 2) Scalar Functions for contour or carpet plots of density, pressure, temperature, Mach number, vorticity magnitude, helicity, etc.; 3) Vector Functions for vector plots of velocity, vorticity, momentum, and density gradient, etc.; 4) Particle Trace Functions for rake-like plots of particle flow or vortex lines; and 5) Shock locations based on pressure gradient. TURB3D is a modification of PLOT3D which is used for viewing CFD simulations of incompressible turbulent flow. Input flow data consists of pressure, velocity and vorticity. Typical quantities to plot include local fluctuations in flow quantities and turbulent production terms, plotted in physical or wall units. PLOT3D/TURB3D includes both TURB3D and PLOT3D because the operation of TURB3D is identical to PLOT3D, and there is no additional sample data or printed documentation for TURB3D. Graphical capabilities of PLOT3D version 3.6b+ vary among the implementations available through COSMIC. Customers are encouraged to purchase and carefully review the PLOT3D manual before ordering the program for a specific computer and graphics library. There is only one manual for use with all implementations of PLOT3D, and although this manual generally assumes that the Silicon Graphics Iris implementation is being used, informative comments concerning other implementations appear throughout the text. With all implementations, the visual representation of the object and flow field created by PLOT3D consists of points, lines, and polygons. Points can be represented with dots or symbols, color can be used to denote data values, and perspective is used to show depth. Differences among implementations impact the program's ability to use graphical features that are based on 3D polygons, the user's ability to manipulate the graphical displays, and the user's ability to obtain alternate forms of output. The Apollo implementation of PLOT3D uses some of the capabilities of
Combinatorial 3D Mechanical Metamaterials
NASA Astrophysics Data System (ADS)
Coulais, Corentin; Teomy, Eial; de Reus, Koen; Shokef, Yair; van Hecke, Martin
2015-03-01
We present a class of elastic structures which exhibit 3D-folding motion. Our structures consist of cubic lattices of anisotropic unit cells that can be tiled in a complex combinatorial fashion. We design and 3d-print this complex ordered mechanism, in which we combine elastic hinges and defects to tailor the mechanics of the material. Finally, we use this large design space to encode smart functionalities such as surface patterning and multistability.
Optical study of the antiferromagnetic ordered state in electron-overdoped Ca0.77Nd0.23FeAs2
NASA Astrophysics Data System (ADS)
Yang, Run; Xu, Bing; Dai, Yaomin; Zhang, Wei; Liu, Jinyun; Qiu, Ziyang; Qiu, Xianggang
2016-06-01
In Ca1 -xRxFeAs2 (R =rare earth), an antiferromagnetic (AFM) phase as well as a structural transition have been reported, even in the electron-overdoped regime. Here, we investigated the temperature-dependent in-plane optical spectroscopy of overdoped Ca0.77Nd0.23FeAs2 . Upon entering the AFM state, we found an abrupt reduction of low-frequency (500-2000 cm-1) spectral weight in the optical conductivity. In sharp contrast to the parent compounds of the 122 system, where spin-density-wave gaps have been clearly observed in the AFM state, a gap signature is absent in Ca0.77Nd0.23FeAs2 . This may be a consequence of the poor nesting condition between the hole and electron pockets. However, a spectral weight analysis shows that the reduced spectral weight at low frequency is transferred to the high-frequency range (≳4000 cm-1), pointing to a localization effect. These observations suggest that the AFM order in Ca0.77Nd0.23FeAs2 is most likely to originate from a localized nature rather than Fermi-surface nesting.
Pikin, S. A. Lyubutin, I. S.
2013-09-15
The thermodynamics of the phase transition in a perovskite-like multiferroic, in which an antiferromagnetic ferroelectric transforms into a new magnetic state where a spiral spin structure and weak ferromagnetism can coexist in applied magnetic field H, is described. This state forms as a result of a first-order phase transition at a certain temperature (below Neel temperature T{sub N}), where a helicoidal magnetic structure appears due to the Dzyaloshinskii-Moriya effect. In this case, the axes of electric polarization and the helicoid of magnetic moments are mutually perpendicular and lie in the ab plane, which is normal to principal axis c. Additional electric polarization p, which decreases the total polarization of the ferroelectric P, appears in the ab plane. The effect of applied magnetic and electric fields on the properties of a multiferroic with a helicoidal magnetic structure is described. An alternating electric field is shown to cause a field-linear change in magnetic moment m, whose sign is opposite to the sign of the change of electric field E. The detected hysteretic phenomena that determine the temperature ranges of overheating and supercooling of each phase are explained. A comparison with the experimental data is performed.
3d-3d correspondence revisited
NASA Astrophysics Data System (ADS)
Chung, Hee-Joong; Dimofte, Tudor; Gukov, Sergei; Sułkowski, Piotr
2016-04-01
In fivebrane compactifications on 3-manifolds, we point out the importance of all flat connections in the proper definition of the effective 3d {N}=2 theory. The Lagrangians of some theories with the desired properties can be constructed with the help of homological knot invariants that categorify colored Jones polynomials. Higgsing the full 3d theories constructed this way recovers theories found previously by Dimofte-Gaiotto-Gukov. We also consider the cutting and gluing of 3-manifolds along smooth boundaries and the role played by all flat connections in this operation.
Shetty, A N; Bis, K G; Vrachliotis, T G; Kirsch, M; Shirkhoda, A; Ellwood, R
1998-01-01
The objective of this study was to determine the clinical utility of a contrast-enhanced, centric reordered, three-dimensional (3D) MR angiography (MRA) pulse sequence in imaging the abdominal aorta and renal and peripheral lower extremity arteries. Twenty-eight MRA studies were performed on 23 patients and four volunteers at 1.5 T using a 3D contrast-enhanced, centric reordered pulse sequence. In 20 patients, the abdominal aorta and renal arteries were imaged, and in seven patients, the lower extremity arteries were imaged. In 19 patients, a total of 51 renal vessels were evaluated (33 renal arteries using .1 mmol/kg of gadopentetate dimeglumine and 18 renal arteries using .2 mmol/kg of gadoteridol). A total of 70 peripheral arterial segments were assessed using .2 mmol/kg of gadoteridol. Correlation with conventional angiography was made for the following 14 cases: renal artery stenosis (four cases), abdominal aortic stenosis (one case), arteriovenous fistula in a transplant kidney (one case), renal arteriovenous malformation (one case), common iliac artery aneurysms (one case), and peripheral lower extremity (six cases). Of the 70 peripheral arterial segments evaluated, in 35, there was correlation with x-ray angiography. The mean percent of aortic signal enhancement was significantly higher in the .2 mmol/kg dose group (370.8 +/- 190.3) than in the .1 mmol/kg dose group (184.5 +/- 128.9) (P = .02). However, there was no apparent difference between the two doses for visualization of the renal and accessory renal arteries. There was concordance between the contrast-enhanced 3D MRA studies and conventional angiography in all cases of renal artery and peripheral arterial stenoses and occlusions, including visualization of reconstituted peripheral arterial segments. There was no evidence of spin dephasing effects at sites of stenoses on the 3D contrast-enhanced MRA studies. Contrast-enhanced, centric reordered, 3D MRA can rapidly image the abdominal aorta and renal
Crystal fields, disorder, and antiferromagnetic short-range order in (Yb{sub 0.24}Sn{sub 0.76})Ru
Klimczuk, T; Wang, C H; Lawrence, J M; Xu, Q; Durakiewicz, T; Ronning, F; Llobet, A; Trouw, F; Kurita, N; Tokiwa, Y; Lee, Han-oh; Booth, C H; Gardner, J S; Bauer, E D; Joyce, J J; Zandbergen, H W; Movshovich, R; Cava, R J; Thompson, J D
2011-07-18
We report extensive measurements on a new compound (Yb{sub 0.24}Sn{sub 0.76})Ru that crystallizes in the cubic CsCl structure. Valence band photoemission and L{sub 3} x-ray absorption show no divalent component in the 4f configuration of Yb. Inelastic neutron scattering (INS) indicates that the eight-fold degenerate J-multiplet of Yb{sup 3+} is split by the crystalline electric field (CEF) into a Γ{sub 7} doublet ground state and a Γ{sub 8} quartet at an excitation energy 20 meV. The magnetic susceptibility can be fit very well by this CEF scheme under the assumption that a Γ{sub 6} excited state resides at 32 meV; however, the Γ{sub 8}/Γ{sub 6} transition expected at 12 meV was not observed in the INS. The resistivity follows a Bloch-Grüneisen law shunted by a parallel resistor, as is typical of systems subject to phonon scattering with no apparent magnetic scattering. All of these properties can be understood as representing simple local moment behavior of the trivalent Yb ion. At 1 K, there is a peak in specific heat that is too broad to represent a magnetic phase transition, consistent with absence of magnetic reflections in neutron diffraction. On the other hand, this peak also is too narrow to represent the Kondo effect in the Γ{sub 7} ground state doublet. On the basis of the field-dependence of the specific heat, we argue that antiferromagnetic shortrange order (possibly co-existing with Kondo physics) occurs at low temperatures. The long-range magnetic order is suppressed because the Yb site occupancy is below the percolation threshold for this disordered compound.
NASA Astrophysics Data System (ADS)
Yang, Xu; Zhang, Yong; Yang, Chenghua; Xu, Lu; Wang, Qiang; Zhao, Yuan
2016-06-01
Conventional three dimensional (3D) ghost imaging measures range of target based on pulse fight time measurement method. Due to the limit of data acquisition system sampling rate, range resolution of the conventional 3D ghost imaging is usually low. In order to take off the effect of sampling rate to range resolution of 3D ghost imaging, a heterodyne 3D ghost imaging (HGI) system is presented in this study. The source of HGI is a continuous wave laser instead of pulse laser. Temporal correlation and spatial correlation of light are both utilized to obtain the range image of target. Through theory analysis and numerical simulations, it is demonstrated that HGI can obtain high range resolution image with low sampling rate.
NASA Astrophysics Data System (ADS)
Meulien Ohlmann, Odile
2013-02-01
Today the industry offers a chain of 3D products. Learning to "read" and to "create in 3D" becomes an issue of education of primary importance. 25 years professional experience in France, the United States and Germany, Odile Meulien set up a personal method of initiation to 3D creation that entails the spatial/temporal experience of the holographic visual. She will present some different tools and techniques used for this learning, their advantages and disadvantages, programs and issues of educational policies, constraints and expectations related to the development of new techniques for 3D imaging. Although the creation of display holograms is very much reduced compared to the creation of the 90ies, the holographic concept is spreading in all scientific, social, and artistic activities of our present time. She will also raise many questions: What means 3D? Is it communication? Is it perception? How the seeing and none seeing is interferes? What else has to be taken in consideration to communicate in 3D? How to handle the non visible relations of moving objects with subjects? Does this transform our model of exchange with others? What kind of interaction this has with our everyday life? Then come more practical questions: How to learn creating 3D visualization, to learn 3D grammar, 3D language, 3D thinking? What for? At what level? In which matter? for whom?
NASA Astrophysics Data System (ADS)
Flock, M.; Dzyurkevich, N.; Klahr, H.; Mignone, A.
2010-06-01
We assess the suitability of various numerical MHD algorithms for astrophysical accretion disk simulations with the PLUTO code. The well-studied linear growth of the magneto-rotational instability is used as the benchmark test for a comparison between the implementations within PLUTO and against the ZeusMP code. The results demonstrate the importance of using an upwind reconstruction of the electro-motive force (EMF) in the context of a constrained transport scheme, which is consistent with plane-parallel, grid-aligned flows. In contrast, constructing the EMF from the simple average of the Godunov fluxes leads to a numerical instability and the unphysical growth of the magnetic energy. We compare the results from 3D global calculations using different MHD methods against the analytical solution for the linear growth of the MRI, and discuss the effect of numerical dissipation. The comparison identifies a robust and accurate code configuration that is vital for realistic modeling of accretion disk processes.
ERIC Educational Resources Information Center
Hastings, S. K.
2002-01-01
Discusses 3 D imaging as it relates to digital representations in virtual library collections. Highlights include X-ray computed tomography (X-ray CT); the National Science Foundation (NSF) Digital Library Initiatives; output peripherals; image retrieval systems, including metadata; and applications of 3 D imaging for libraries and museums. (LRW)
Amador, J.; Gutierrez-Puebla, E.; Monge, M.A.; Rasines, I.; Ruriaaz-Valero, C. ); Fernandez, F.; Saez-Puche, R. ); Campa, J.A. )
1990-11-01
Crystals of {ital R}{sub 2}BaNiO{sub 5} ({ital R}=Y,Er) have been grown, and their structures have been established by single-crystal x-ray diffraction. Both compounds crystallize in the Nd{sub 2}BaNiO{sub 5} structure type, with one-dimensional chains of vertex-sharing NiO{sub 6} octahedra in the direction of the {bold a} axis. These octahedra show an unusual twofold distortion: The Ni-O distances to the two axial oxygen atoms are considerably shorter, 0.3 A, than those to the four equatorial oxygens, and these oxygens are distorted from the right angles of a regular octahedron to 79.0(2){degree} or 77.7(6){degree}, respectively. As a result of this, Ni-O(axial)-Ni distances are very short, 3.76 and 3.75 A for {ital R}=Y and Er, respectively. X-ray powder diffraction data and the results of magnetic measurements for both oxides are given. The structural features mentioned elucidate why Ni{sup 2+} ions in polycrystalline Y{sub 2}BaNiO{sub 5} behave as a monodimensional system in which they become antiferromagnetically ordered below 300 K. Besides that, the ferromagnetic interactions that operate below 40 K can be due to tridimensional interchain interactions and/or the presence of ferromagnetic impurities. The estimated Neel temperature for Y{sub 2}BaNiO{sub 5}, higher than that reported for Y{sub 2}BaCuO{sub 5}, is explained by the promotion of the superexchange Ni-O-Ni interactions along the chains of flattened NiO{sub 6} octahedra sharing corners. In Er{sub 2}BaNiO{sub 5} both effects are masked by the strong paramagnetic signal of Er{sup 3+}, and a maximum observed at 15.6 K for the susceptibility is attributed to tridimensional ordering of the Er{sup 3+} cations.
Intrinsic magnetization of antiferromagnetic textures
NASA Astrophysics Data System (ADS)
Tveten, Erlend G.; Müller, Tristan; Linder, Jacob; Brataas, Arne
2016-03-01
Antiferromagnets (AFMs) exhibit intrinsic magnetization when the order parameter spatially varies. This intrinsic spin is present even at equilibrium and can be interpreted as a twisting of the homogeneous AFM into a state with a finite spin. Because magnetic moments couple directly to external magnetic fields, the intrinsic magnetization can alter the dynamics of antiferromagnetic textures under such influence. Starting from the discrete Heisenberg model, we derive the continuum limit of the free energy of AFMs in the exchange approximation and explicitly rederive that the spatial variation of the antiferromagnetic order parameter is associated with an intrinsic magnetization density. We calculate the magnetization profile of a domain wall and discuss how the intrinsic magnetization reacts to external forces. We show conclusively, both analytically and numerically, that a spatially inhomogeneous magnetic field can move and control the position of domain walls in AFMs. By comparing our model to a commonly used alternative parametrization procedure for the continuum fields, we show that the physical interpretations of these fields depend critically on the choice of parametrization procedure for the discrete-to-continuous transition. This can explain why a significant amount of recent studies of the dynamics of AFMs, including effective models that describe the motion of antiferromagnetic domain walls, have neglected the intrinsic spin of the textured order parameter.
NASA Astrophysics Data System (ADS)
Prudnikov, Vladimir V.; Prudnikov, Pavel V.; Pospelov, Evgeny A.
2016-04-01
We have performed a numerical investigation of the influence of disorder on the dynamical non-equilibrium evolution of a 3D site-diluted Ising model from a low-temperature initial state with magnetization m 0 = 1. It is shown that two-time dependences of the autocorrelation and integrated response functions for systems with spin concentrations p = 1.0, 0.95, 0.8, 0.6 and 0.5 demonstrate ageing properties with anomalous slowing-down relaxation and violation of the fluctuation-dissipation ratio. It was revealed that during non-equilibrium critical dynamics in the long-time regime t-{{t}\\text{w}}\\gg {{t}\\text{w}}\\gg 1 the autocorrelation functions for diluted systems are extremely slow due to the pinning of domain walls on impurity sites. We have found that the fluctuation-dissipation ratio {{X}∞}=0 for diluted systems with spin concentration p < 1 while the pure system is characterized by {{X}∞}=0.784(7) . The autocorrelation function power-law delay becomes the same as for the time dependence of the magnetization in the critical point and is characterized by exponent -β /zν . Also, for diluted systems we reveal memory effects for critical evolution in the ageing regime with realization of cyclic temperature change and quenching at T<{{T}\\text{c}} .
NASA Astrophysics Data System (ADS)
Avrin, Joel
2014-11-01
In a bounded region in 3-D the velocity field u for the Navier-Stokes system satisfies in the no-slip case the familiar condition u = 0 on the boundary. We show further that if the boundary and the forcing data satisfy reasonably general smoothness assumptions then Au = 0 on the boundary as well where A is the Stokes operator (i.e. Au is the divergence-free part of -∇2 u). We apply this result to subgrid-scale modeling by noting that in a number of computational turbulence experiments hyperviscosity has been added to the NS system as an approximation to spectral eddy viscosity, but a rigorous definition of this technique and a qualitative theory for it has been restricted to the idealized case of box regions with periodic boundary conditions imposed on each face. But under the above smoothness assumptions the fact that Au = 0 on the boundary now allows us in the no-slip case to rigorously define adding hyperviscosity to the Navier-Stokes system on otherwise general bounded regions. We can also obtain a foundational qualitative theory for this system as well as for spectral hyperviscosity, which adds hyperviscosity only to the high frequencies past a cutoff wavenumber.
X-ray Diffraction Study of Order-Disorder Phase Transition in CuMPt6 (M=3d Elements) Alloys
NASA Astrophysics Data System (ADS)
Ahmed, Ejaz; Takahashi, Miwako; Iwasaki, Hiroshi; Ohshima, Ken-ichi
2009-01-01
We investigated the ordering behavior of ternary CuMPt6 alloys with M=Ti, V, Cr, Mn, Fe, Co, and Ni by high-temperature polycrystalline X-ray diffraction. The alloys undergo a phase transition from the fcc disordered state to the Cu3Au-type ordered state, except for the alloy with M=Ni, in which only short-range order forms. The transition temperature Tc is highest (1593 K) for M=Ti and decreases almost monotonically with increasing atomic number to 1153 K for M=Co. The observed dependence of ordering tendency on the atomic number of M is discussed in the light of the theory of ordering in transition-metal alloys and its significance for the study of ordering in ternary alloys.
Crandall, K.R.
1987-08-01
TRACE 3-D is an interactive beam-dynamics program that calculates the envelopes of a bunched beam, including linear space-charge forces, through a user-defined transport system. TRACE 3-D provides an immediate graphics display of the envelopes and the phase-space ellipses and allows nine types of beam-matching options. This report describes the beam-dynamics calculations and gives detailed instruction for using the code. Several examples are described in detail.
Interplay of 3 d-5 d interactions in high-TC osmium-based double perovskites
NASA Astrophysics Data System (ADS)
Taylor, A. E.; Calder, S.; Morrow, R.; Woodward, P. M.; Yan, J. Q.; Winn, B.; Lumsden, M. D.; Christianson, A. D.
2015-03-01
In 3d-5d systems the strongly magnetic 3d orbitals and extended 5d orbitals with enhanced spin-orbit coupling lead to a range of high TC magnetic states and novel behavior not present in systems consisting solely of 3d or 5d ions. The two distinct octahedral sites in double perovskites A2 BB 'O6 allow an ordered 3d-5d structure to form, providing a variety of systems to be investigated. Unravelling the interactions controlling these systems, however, is an open challenge. The highest known TC in such a system, 725K, is found in insulator Sr2CrOsO6. This questions the theory for high-TCs in systems such as TC=400K Sr2FeReO6 which relies on half-metallic behavior. To unravel the nature of the interactions in 3d-5d systems, we have studied the series of compounds Sr2 X OsO6. We have utilized elastic and inelastic neutron scattering to probe the spin states in the systems, and therefore test predictions that the magnetic interactions are controlled by a frustrated AFM Heisenberg model. By studying the series, we are able to relate changes in the spin wave spectrum to dramatic changes in the magnetic order from TN = 95 K antiferromagnetism to TC = 725 K ferrimagnetism.
Lytvyn, P M; Mazur, Yu I; Marega, E; Dorogan, V G; Kladko, V P; Slobodian, M V; Strelchuk, V V; Hussein, M L; Ware, M E; Salamo, G J
2008-12-17
Lateral ordering of InGaAs quantum dots on the GaAs (001) surface has been achieved in earlier reports, resembling an anisotropic pattern. In this work, we present a method of breaking the anisotropy of ordered quantum dots (QDs) by changing the growth environment. We show experimentally that using As(2) molecules instead of As(4) as a background flux is efficient in controlling the diffusion of distant Ga adatoms to make it possible to produce isotropic ordering of InGaAs QDs over GaAs (001). The control of the lateral ordering of QDs under As(2) flux has enabled us to improve their optical properties. Our results are consistent with reported experimental and theoretical data for structure and diffusion on the GaAs surface. PMID:19942777
NASA Astrophysics Data System (ADS)
Bruno, Oscar P.; Cubillos, Max
2016-02-01
This paper introduces alternating-direction implicit (ADI) solvers of higher order of time-accuracy (orders two to six) for the compressible Navier-Stokes equations in two- and three-dimensional curvilinear domains. The higher-order accuracy in time results from 1) An application of the backward differentiation formulae time-stepping algorithm (BDF) in conjunction with 2) A BDF-like extrapolation technique for certain components of the nonlinear terms (which makes use of nonlinear solves unnecessary), as well as 3) A novel application of the Douglas-Gunn splitting (which greatly facilitates handling of boundary conditions while preserving higher-order accuracy in time). As suggested by our theoretical analysis of the algorithms for a variety of special cases, an extensive set of numerical experiments clearly indicate that all of the BDF-based ADI algorithms proposed in this paper are "quasi-unconditionally stable" in the following sense: each algorithm is stable for all couples (h , Δt)of spatial and temporal mesh sizes in a problem-dependent rectangular neighborhood of the form (0 ,Mh) × (0 ,Mt). In other words, for each fixed value of Δt below a certain threshold, the Navier-Stokes solvers presented in this paper are stable for arbitrarily small spatial mesh-sizes. The second-order formulation has further been rigorously shown to be unconditionally stable for linear hyperbolic and parabolic equations in two-dimensional space. Although implicit ADI solvers for the Navier-Stokes equations with nominal second-order of temporal accuracy have been proposed in the past, the algorithms presented in this paper are the first ADI-based Navier-Stokes solvers for which second-order or better accuracy has been verified in practice under non-trivial (non-periodic) boundary conditions.
Effect of Additional 3d Elements M (M = Fe and Ni) on Atomic Ordered Structure in Cu-M-Pd alloy
NASA Astrophysics Data System (ADS)
Ahmad, Naseeb; Takahashi, Miwako; Bashir Ziya, Amer; Ohshima, Ken-ichi
X-ray diffraction measurements were performed to elucidate the effect of ternary addition of Fe and Ni elements to Cu-rich Cu-Pd binary alloy system on the structure and an atomic ordering. X-ray polycrystalline diffraction patterns of the specimens quenched from 900 °C have shown that a single phase with face-centered cubic (fcc) structure is formed in all the specimens for Ni system and in specimens with Pd composition xPd (at. %) more than 10 for Fe system. After appropriate heat treatment, the Fe system a fcc single phase forms fcc-based Cu3Au-type ordered structure for xPd around 20, and body-centered-cubic based CsCl-type ordered structure xPd for around 40. Assuming that Fe atoms simply substitute for Cu atoms in the ordered structures, the atomic phase coincides well with that of Cu-Pd alloys for the Cu3Au-type structure, but there is a discrepancy for the CsCl-type structure on that it does not appear as a single phase in Cu-Fe-Pd alloys. As for Ni system, no ordered structures are formed except for the alloys with xPd more than 35, in which fcc and CsCl-type structures are found to coexist.
NASA Astrophysics Data System (ADS)
Oldham, Mark
2015-01-01
Radiochromic materials exhibit a colour change when exposed to ionising radiation. Radiochromic film has been used for clinical dosimetry for many years and increasingly so recently, as films of higher sensitivities have become available. The two principle advantages of radiochromic dosimetry include greater tissue equivalence (radiologically) and the lack of requirement for development of the colour change. In a radiochromic material, the colour change arises direct from ionising interactions affecting dye molecules, without requiring any latent chemical, optical or thermal development, with important implications for increased accuracy and convenience. It is only relatively recently however, that 3D radiochromic dosimetry has become possible. In this article we review recent developments and the current state-of-the-art of 3D radiochromic dosimetry, and the potential for a more comprehensive solution for the verification of complex radiation therapy treatments, and 3D dose measurement in general.
NASA Astrophysics Data System (ADS)
Iliesiu, Luca; Kos, Filip; Poland, David; Pufu, Silviu S.; Simmons-Duffin, David; Yacoby, Ran
2016-03-01
We study the conformal bootstrap for a 4-point function of fermions < ψψψψ> in 3D. We first introduce an embedding formalism for 3D spinors and compute the conformal blocks appearing in fermion 4-point functions. Using these results, we find general bounds on the dimensions of operators appearing in the ψ × ψ OPE, and also on the central charge C T . We observe features in our bounds that coincide with scaling dimensions in the GrossNeveu models at large N . We also speculate that other features could coincide with a fermionic CFT containing no relevant scalar operators.
Kaltenbacher, Barbara; Kaltenbacher, Manfred; Sim, Imbo
2013-01-01
We consider the second order wave equation in an unbounded domain and propose an advanced perfectly matched layer (PML) technique for its efficient and reliable simulation. In doing so, we concentrate on the time domain case and use the finite-element (FE) method for the space discretization. Our un-split-PML formulation requires four auxiliary variables within the PML region in three space dimensions. For a reduced version (rPML), we present a long time stability proof based on an energy analysis. The numerical case studies and an application example demonstrate the good performance and long time stability of our formulation for treating open domain problems. PMID:23888085
Kaltenbacher, Barbara; Kaltenbacher, Manfred; Sim, Imbo
2013-02-15
We consider the second order wave equation in an unbounded domain and propose an advanced perfectly matched layer (PML) technique for its efficient and reliable simulation. In doing so, we concentrate on the time domain case and use the finite-element (FE) method for the space discretization. Our un-split-PML formulation requires four auxiliary variables within the PML region in three space dimensions. For a reduced version (rPML), we present a long time stability proof based on an energy analysis. The numerical case studies and an application example demonstrate the good performance and long time stability of our formulation for treating open domain problems. PMID:23888085
NASA Astrophysics Data System (ADS)
Kaltenbacher, Barbara; Kaltenbacher, Manfred; Sim, Imbo
2013-02-01
We consider the second order wave equation in an unbounded domain and propose an advanced perfectly matched layer (PML) technique for its efficient and reliable simulation. In doing so, we concentrate on the time domain case and use the finite-element (FE) method for the space discretization. Our un-split-PML formulation requires four auxiliary variables within the PML region in three space dimensions. For a reduced version (rPML), we present a long time stability proof based on an energy analysis. The numerical case studies and an application example demonstrate the good performance and long time stability of our formulation for treating open domain problems.
Tong, Zhongqiu; Lv, Haiming; Zhang, Xiang; Yang, Haowei; Tian, Yanlong; Li, Na; Zhao, Jiupeng; Li, Yao
2015-01-01
Because vanadium pentoxide (V2O5) is the only oxide that shows both anodic and cathodic coloration electrochromism, the reversible lithium ion insertion/extraction processes in V2O5 lead to not only reversible optical parameter changes but also multicolor changes for esthetics. Because of the outstanding electrochemical properties of V2O5 nanofibers, they show great potential to enhance V2O5 electrochromism. However, the development and practical application of V2O5 nanofibers are still lacking, because traditional preparation approaches have several drawbacks, such as multiple processing steps, unsatisfactory electrical contact with the substrate, expensive equipment, and rigorous experimental conditions. Herein, we first report a novel and convenient strategy to prepare grass-like nanofiber-stacked V2O5 films by a simple annealing treatment of an amorphous, three-dimensionally ordered macroporous vanadia film. The V2O5 nanofiber grassland exhibits promising transmittance modulation, fast switching responses, and high color contrast because of the outstanding electrochemical properties of V2O5 nanofibers as well as the high Li-ion diffusion coefficients and good electrical contact with the substrate. Moreover, the morphology transformation mechanism is investigated in detail. PMID:26578383
NASA Astrophysics Data System (ADS)
Tong, Zhongqiu; Lv, Haiming; Zhang, Xiang; Yang, Haowei; Tian, Yanlong; Li, Na; Zhao, Jiupeng; Li, Yao
2015-11-01
Because vanadium pentoxide (V2O5) is the only oxide that shows both anodic and cathodic coloration electrochromism, the reversible lithium ion insertion/extraction processes in V2O5 lead to not only reversible optical parameter changes but also multicolor changes for esthetics. Because of the outstanding electrochemical properties of V2O5 nanofibers, they show great potential to enhance V2O5 electrochromism. However, the development and practical application of V2O5 nanofibers are still lacking, because traditional preparation approaches have several drawbacks, such as multiple processing steps, unsatisfactory electrical contact with the substrate, expensive equipment, and rigorous experimental conditions. Herein, we first report a novel and convenient strategy to prepare grass-like nanofiber-stacked V2O5 films by a simple annealing treatment of an amorphous, three-dimensionally ordered macroporous vanadia film. The V2O5 nanofiber grassland exhibits promising transmittance modulation, fast switching responses, and high color contrast because of the outstanding electrochemical properties of V2O5 nanofibers as well as the high Li-ion diffusion coefficients and good electrical contact with the substrate. Moreover, the morphology transformation mechanism is investigated in detail.
Tong, Zhongqiu; Lv, Haiming; Zhang, Xiang; Yang, Haowei; Tian, Yanlong; Li, Na; Zhao, Jiupeng; Li, Yao
2015-01-01
Because vanadium pentoxide (V2O5) is the only oxide that shows both anodic and cathodic coloration electrochromism, the reversible lithium ion insertion/extraction processes in V2O5 lead to not only reversible optical parameter changes but also multicolor changes for esthetics. Because of the outstanding electrochemical properties of V2O5 nanofibers, they show great potential to enhance V2O5 electrochromism. However, the development and practical application of V2O5 nanofibers are still lacking, because traditional preparation approaches have several drawbacks, such as multiple processing steps, unsatisfactory electrical contact with the substrate, expensive equipment, and rigorous experimental conditions. Herein, we first report a novel and convenient strategy to prepare grass-like nanofiber-stacked V2O5 films by a simple annealing treatment of an amorphous, three-dimensionally ordered macroporous vanadia film. The V2O5 nanofiber grassland exhibits promising transmittance modulation, fast switching responses, and high color contrast because of the outstanding electrochemical properties of V2O5 nanofibers as well as the high Li-ion diffusion coefficients and good electrical contact with the substrate. Moreover, the morphology transformation mechanism is investigated in detail. PMID:26578383
Ferromagnetic response of a ``high-temperature'' quantum antiferromagnet
NASA Astrophysics Data System (ADS)
Wang, Xin
2014-03-01
We study the antiferromagnetic phase of the ionic Hubbard model at finite temperature using dynamical mean-field theory. We find that the ionic potential plays a dual role in determining the antiferromagnetic order. A small ionic potential (compared to the Hubbard repulsion) increases the super-exchange coupling, thereby implying an increase of the Neel temperature of the system, which should facilitate observation of antiferromagnetic ordering experimentally. On the other hand, for large ionic potential, the antiferromagnetic ordering is killed and the system becomes a charge density wave with electron occupancies alternating between 0 and 2. This novel way of degrading antiferromagnetism leads to spin polarization of the low energy single particle density of states. The dynamic response of the system thus mimics ferromagnetic behavior, although the system is still an antiferromagnet in terms of the static spin order. Work done in collaboration with Rajdeep Sensarma and Sankar Das Sarma, and supported by NSF-JQI-PFC, AFOSR MURI, and ARO MURI.
Moortgat, Joachim Firoozabadi, Abbas
2013-10-01
Numerical simulation of multiphase compositional flow in fractured porous media, when all the species can transfer between the phases, is a real challenge. Despite the broad applications in hydrocarbon reservoir engineering and hydrology, a compositional numerical simulator for three-phase flow in fractured media has not appeared in the literature, to the best of our knowledge. In this work, we present a three-phase fully compositional simulator for fractured media, based on higher-order finite element methods. To achieve computational efficiency, we invoke the cross-flow equilibrium (CFE) concept between discrete fractures and a small neighborhood in the matrix blocks. We adopt the mixed hybrid finite element (MHFE) method to approximate convective Darcy fluxes and the pressure equation. This approach is the most natural choice for flow in fractured media. The mass balance equations are discretized by the discontinuous Galerkin (DG) method, which is perhaps the most efficient approach to capture physical discontinuities in phase properties at the matrix-fracture interfaces and at phase boundaries. In this work, we account for gravity and Fickian diffusion. The modeling of capillary effects is discussed in a separate paper. We present the mathematical framework, using the implicit-pressure-explicit-composition (IMPEC) scheme, which facilitates rigorous thermodynamic stability analyses and the computation of phase behavior effects to account for transfer of species between the phases. A deceptively simple CFL condition is implemented to improve numerical stability and accuracy. We provide six numerical examples at both small and larger scales and in two and three dimensions, to demonstrate powerful features of the formulation.
NASA Astrophysics Data System (ADS)
Shick, A. B.; Khmelevskyi, S.; Mryasov, O. N.; Wunderlich, J.; Jungwirth, T.
2010-06-01
Magnetic anisotropy phenomena in bimetallic antiferromagnets Mn2Au and MnIr are studied by first-principles density-functional theory calculations. We find strong and lattice-parameter-dependent magnetic anisotropies of the ground-state energy, chemical potential, and density of states, and attribute these anisotropies to combined effects of large moment on the Mn3d shell and large spin-orbit coupling on the 5d shell of the noble metal. Large magnitudes of the proposed effects can open a route towards spintronics in compensated antiferromagnets without involving ferromagnetic elements.
Belenkov, E. A. Ali-Pasha, V. A.
2011-01-15
The structure of clusters of some new carbon 3D-graphite phases have been calculated using the molecular-mechanics methods. It is established that 3D-graphite polytypes {alpha}{sub 1,1}, {alpha}{sub 1,3}, {alpha}{sub 1,5}, {alpha}{sub 2,1}, {alpha}{sub 2,3}, {alpha}{sub 3,1}, {beta}{sub 1,2}, {beta}{sub 1,4}, {beta}{sub 1,6}, {beta}{sub 2,1}, and {beta}{sub 3,2} consist of sp{sup 2}-hybridized atoms, have hexagonal unit cells, and differ in regards to the structure of layers and order of their alternation. A possible way to experimentally synthesize new carbon phases is proposed: the polymerization and carbonization of hydrocarbon molecules.
3-D structures of planetary nebulae
NASA Astrophysics Data System (ADS)
Steffen, W.
2016-07-01
Recent advances in the 3-D reconstruction of planetary nebulae are reviewed. We include not only results for 3-D reconstructions, but also the current techniques in terms of general methods and software. In order to obtain more accurate reconstructions, we suggest to extend the widely used assumption of homologous nebula expansion to map spectroscopically measured velocity to position along the line of sight.
NASA Astrophysics Data System (ADS)
Tobey, R. I.; Wall, S.; Först, M.; Bromberger, H.; Khanna, V.; Turner, J. J.; Schlotter, W.; Trigo, M.; Krupin, O.; Lee, W. S.; Chuang, Y.-D.; Moore, R.; Cavalieri, A. L.; Wilkins, S. B.; Zheng, H.; Mitchell, J. F.; Dhesi, S. S.; Cavalleri, A.; Hill, J. P.
2012-08-01
Using time-resolved resonant soft x-ray diffraction, we measure the evolution of the full three-dimensional scattering volume of the antiferromagnetic superlattice reflection in the single-layer manganite La0.5Sr1.5MnO4on femtosecond time scales following photoexcitation. We find that the in-plane correlations are unchanged as a metastable state is entered, however there are subtle changes in the c-axis correlations. We observe a transient shift of the scattering ellipsoid along (00L) at very short times, and at longer time scales the short-range c-axis correlations are more robust than they are in equilibrium. Such results are not obtainable with any other techniques and hint at previously unresolved processes in the dynamics of photomelting in strongly correlated systems.
Solitonlike magnetization textures in noncollinear antiferromagnets
NASA Astrophysics Data System (ADS)
Ulloa, Camilo; Nunez, A. S.
2016-04-01
We show that proper control of magnetization textures can be achieved in noncollinear antiferromagnets. This opens the versatile toolbox of domain-wall manipulation in the context of a different family of materials. In this way, we show that noncollinear antiferromagnets are a good prospect for applications in the context of antiferromagnetic spintronics. As in many noncollinear antiferromagnets, the order parameter field takes values in SO(3). By performing a gradient expansion in the energy functional we derive an effective theory that accounts for the physics of the magnetization of long-wavelength excitations. We apply our formalism to static and dynamic textures such as domain walls and localized oscillations, and identify topologically protected textures that are spatially localized. Our results are applicable to the exchange-bias materials Mn3X , with X =Ir,Rh,Pt .
Antiferromagnetic magnonic crystals
NASA Astrophysics Data System (ADS)
Troncoso, Roberto E.; Ulloa, Camilo; Pesce, Felipe; Nunez, A. S.
2015-12-01
We describe the features of magnonic crystals based upon antiferromagnetic elements. Our main results are that with a periodic modulation of either magnetic fields or system characteristics, such as the anisotropy, it is possible to tailor the spin-wave spectra of antiferromagnetic systems into a band-like organization that displays a segregation of allowed and forbidden bands. The main features of the band structure, such as bandwidths and band gaps, can be readily manipulated. Our results provide a natural link between two steadily growing fields of spintronics: antiferromagnetic spintronics and magnonics.
NASA Astrophysics Data System (ADS)
Kostrzewski, Andrew A.; Aye, Tin M.; Kim, Dai Hyun; Esterkin, Vladimir; Savant, Gajendra D.
1998-09-01
Physical Optics Corporation has developed an advanced 3-D virtual reality system for use with simulation tools for training technical and military personnel. This system avoids such drawbacks of other virtual reality (VR) systems as eye fatigue, headaches, and alignment for each viewer, all of which are due to the need to wear special VR goggles. The new system is based on direct viewing of an interactive environment. This innovative holographic multiplexed screen technology makes it unnecessary for the viewer to wear special goggles.
NASA Technical Reports Server (NTRS)
1992-01-01
Ames Research Center research into virtual reality led to the development of the Convolvotron, a high speed digital audio processing system that delivers three-dimensional sound over headphones. It consists of a two-card set designed for use with a personal computer. The Convolvotron's primary application is presentation of 3D audio signals over headphones. Four independent sound sources are filtered with large time-varying filters that compensate for motion. The perceived location of the sound remains constant. Possible applications are in air traffic control towers or airplane cockpits, hearing and perception research and virtual reality development.
Cevidanes, Lucia; Tucker, Scott; Styner, Martin; Kim, Hyungmin; Chapuis, Jonas; Reyes, Mauricio; Proffit, William; Turvey, Timothy; Jaskolka, Michael
2009-01-01
This paper discusses the development of methods for computer-aided jaw surgery. Computer-aided jaw surgery allows us to incorporate the high level of precision necessary for transferring virtual plans into the operating room. We also present a complete computer-aided surgery (CAS) system developed in close collaboration with surgeons. Surgery planning and simulation include construction of 3D surface models from Cone-beam CT (CBCT), dynamic cephalometry, semi-automatic mirroring, interactive cutting of bone and bony segment repositioning. A virtual setup can be used to manufacture positioning splints for intra-operative guidance. The system provides further intra-operative assistance with the help of a computer display showing jaw positions and 3D positioning guides updated in real-time during the surgical procedure. The CAS system aids in dealing with complex cases with benefits for the patient, with surgical practice, and for orthodontic finishing. Advanced software tools for diagnosis and treatment planning allow preparation of detailed operative plans, osteotomy repositioning, bone reconstructions, surgical resident training and assessing the difficulties of the surgical procedures prior to the surgery. CAS has the potential to make the elaboration of the surgical plan a more flexible process, increase the level of detail and accuracy of the plan, yield higher operative precision and control, and enhance documentation of cases. Supported by NIDCR DE017727, and DE018962 PMID:20816308
Phase Diagram of a Three-Dimensional Antiferromagnet with Random Magnetic Anisotropy
Perez, Felio A.; Borisov, Pavel; Johnson, Trent A.; Stanescu, Tudor D.; Trappen, Robbyn; Holcomb, Mikel B.; Lederman, David; Fitzsimmons, M. R.; Aczel, Adam A.; Hong, Tao
2015-03-04
Three-dimensional (3D) antiferromagnets with random magnetic anisotropy (RMA) that were experimentally studied to date have competing two-dimensional and three-dimensional exchange interactions which can obscure the authentic effects of RMA. The magnetic phase diagram of Fe_{x}Ni_{1-x}F_{2} epitaxial thin films with true random single-ion anisotropy was deduced from magnetometry and neutron scattering measurements and analyzed using mean field theory. Regions with uniaxial, oblique and easy plane anisotropies were identified. A RMA-induced glass region was discovered where a Griffiths-like breakdown of long-range spin order occurs.
Phase Diagram of a Three-Dimensional Antiferromagnet with Random Magnetic Anisotropy
Perez, Felio A.; Borisov, Pavel; Johnson, Trent A.; Stanescu, Tudor D.; Trappen, Robbyn; Holcomb, Mikel B.; Lederman, David; Fitzsimmons, M. R.; Aczel, Adam A.; Hong, Tao
2015-03-04
Three-dimensional (3D) antiferromagnets with random magnetic anisotropy (RMA) that were experimentally studied to date have competing two-dimensional and three-dimensional exchange interactions which can obscure the authentic effects of RMA. The magnetic phase diagram of FexNi1-xF2 epitaxial thin films with true random single-ion anisotropy was deduced from magnetometry and neutron scattering measurements and analyzed using mean field theory. Regions with uniaxial, oblique and easy plane anisotropies were identified. A RMA-induced glass region was discovered where a Griffiths-like breakdown of long-range spin order occurs.
Lin, J. C.; Tong, P. Lin, S.; Wang, B. S.; Song, W. H.; Tong, W.; Zou, Y. M.; Sun, Y. P.
2015-02-23
The thermal expansion and magnetic properties of antiperovskite manganese nitrides Ag{sub 1−x}NMn{sub 3+x} were reported. The substitution of Mn for Ag effectively broadens the temperature range of negative thermal expansion and drives it to cryogenic temperatures. As x increases, the paramagnetic (PM) to antiferromagnetic (AFM) phase transition temperature decreases. At x ∼ 0.2, the PM-AFM transition overlaps with the AFM to glass-like state transition. Above x = 0.2, two new distinct magnetic transitions were observed: One occurs above room temperature from PM to ferromagnetic (FM), and the other one evolves at a lower temperature (T{sup *}) below which both AFM and FM orderings are involved. Further, electron spin resonance measurement suggests that the broadened volume change near T{sup *} is closely related with the evolution of Γ{sup 5g} AFM ordering.
NASA Astrophysics Data System (ADS)
Lin, J. C.; Tong, P.; Tong, W.; Lin, S.; Wang, B. S.; Song, W. H.; Zou, Y. M.; Sun, Y. P.
2015-02-01
The thermal expansion and magnetic properties of antiperovskite manganese nitrides Ag1-xNMn3+x were reported. The substitution of Mn for Ag effectively broadens the temperature range of negative thermal expansion and drives it to cryogenic temperatures. As x increases, the paramagnetic (PM) to antiferromagnetic (AFM) phase transition temperature decreases. At x ˜ 0.2, the PM-AFM transition overlaps with the AFM to glass-like state transition. Above x = 0.2, two new distinct magnetic transitions were observed: One occurs above room temperature from PM to ferromagnetic (FM), and the other one evolves at a lower temperature (T*) below which both AFM and FM orderings are involved. Further, electron spin resonance measurement suggests that the broadened volume change near T* is closely related with the evolution of Γ5g AFM ordering.
Antiferromagnetic phases of the Kondo lattice
NASA Astrophysics Data System (ADS)
Eder, R.; Grube, K.; Wróbel, P.
2016-04-01
We discuss the paramagnetic and Néel-ordered phases of the Kondo lattice Hamiltonian on the two-dimensional square lattice by means of bond fermions. In the doped case we find two antiferromagnetic solutions, the first one with small ordered moment, heavy bands, and an antiferromagnetically folded large Fermi surface—i.e., including the localized spins—the second one with large ordered moment, light bands, and an antiferromagnetically folded conduction electron-only Fermi surface. The zero temperature phase diagram as a function of Kondo coupling and conduction electron density shows first- and second-order transition lines between the three different phases and agrees qualitatively with previous numerical studies. We compare to experiments on CeRh1 -xCoxIn5 and find qualitative agreement.
NASA Astrophysics Data System (ADS)
Wright, G.; Flyer, N.; Yuen, D. A.; Monnereau, M.; Zhang, S.; Wang, S. M.
2009-05-01
Many numerical methods, such as finite-differences, finite-volume, their yin-yang variants, finite-elements and spectral methods have been employed to study 3-D mantle convection. All have their own strengths, but also serious weaknesses. Spectrally accurate methods do not practically allow for node refinement and often involve cumbersome algebra while finite difference, volume, or element methods are generally low-order, adding excessive numerical diffusion to the model. For the 3-D mantle convection problem, we have introduced a new mesh-free approach, using radial basis functions (RBF). This method has the advantage of being algorithmic simple, spectrally accurate for arbitrary node layouts in multi-dimensions and naturally allows for node-refinement. One virtue of the RBF scheme allows the user to use a simple Cartesian geometry, while implementing the required boundary conditions for the temperature, velocities and stress components on a spherical surface at both the planetary surface and the core-mantle boundary. We have studied time- dependent mantle convection, using both a RBF-pseudospectral code and a code which uses spherical- harmonics in the angular direction and second-order finite volume in the radial direction. We have employed a third code , which uses spherical harmonics and higher-order finite-difference method a la Fornberg in the radial coordinate.We first focus on the onset of time-dependence at Rayleigh number Ra of 70,000. We follow the development of stronger time-dependence to a Ra of one million, using high enough resolution with 120 to 200 points in the radial direction and 128 to 256 spherical harmonics.
Spin-Hall effects in metallic antiferromagnets
NASA Astrophysics Data System (ADS)
Zhang, Wei
Materials possessing new parameters for efficient and tunable spin Hall effects are being explored, among which antiferromagnets have become one of the most promising candidates. Two distinct properties of antiferromagnets are the microscopic spin magnetic moment ordering and the intrinsic anisotropy. Thus the natural question arises whether these two unique features of antiferromagnets can become new degrees of freedom for tuning their spin Hall effects. We performed experimental studies using spin pumping and inverse spin Hall detection on prototypical CuAu-I-type metallic antiferromagnets, PtMn, IrMn, PdMn, and FeMn, in which we observed increasing spin Hall effects for the alloys with heavier elements included. In particular, PtMn shows a large spin Hall effect that is comparable to Pt. We also demonstrated that the spin transfer torques from the antiferromagnets are large enough to excite ferromagnetic resonance of an adjacent ferromagnetic layer. We conclude that the sign and magnitude of the spin Hall effects in these antiferromagnets are determined by the atomic spin-orbit coupling of the heavy elements (e.g. Pt and Ir) as well as the large spin magnetic moments of Mn. In addition, by using epitaxial growth, we investigated the influence of the different crystalline and magnetic orientations on the anisotropic spin Hall effects of these antiferromagnets. Most of the experimental results were further corroborated by first-principles calculations, which determine the intrinsic spin Hall effect contribution and suggest pronounced anisotropies. Thus metallic antiferromagnets may become an active component for manipulating spin dependent transport properties in spintronic concepts. Work at Argonne was supported by the U.S. DOE, OS, Materials Sciences and Engineering Division. Work at Center for Nanoscale Materials was supported by DOE, OS-BES (DE-AC02-06CH11357). Work at Julich was supported by SPP 1538 Programme of the DFG.
NASA Astrophysics Data System (ADS)
Gil, José J.; San José, Ignacio
2010-11-01
From our previous definition of the indices of polarimetric purity for 3D light beams [J.J. Gil, J.M. Correas, P.A. Melero and C. Ferreira, Monogr. Semin. Mat. G. de Galdeano 31, 161 (2004)], an analysis of their geometric and physical interpretation is presented. It is found that, in agreement with previous results, the first parameter is a measure of the degree of polarization, whereas the second parameter (called the degree of directionality) is a measure of the mean angular aperture of the direction of propagation of the corresponding light beam. This pair of invariant, non-dimensional, indices of polarimetric purity contains complete information about the polarimetric purity of a light beam. The overall degree of polarimetric purity is obtained as a weighted quadratic average of the degree of polarization and the degree of directionality.