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Sample records for lcao method

  1. Unfolding method for first-principles LCAO electronic structure calculations

    NASA Astrophysics Data System (ADS)

    Lee, Chi-Cheng; Yamada-Takamura, Yukiko; Ozaki, Taisuke

    2013-08-01

    Unfolding the band structure of a supercell to a normal cell enables us to investigate how symmetry breakers such as surfaces and impurities perturb the band structure of the normal cell. We generalize the unfolding method, originally developed based on Wannier functions, to the linear combination of atomic orbitals (LCAO) method, and present a general formula to calculate the unfolded spectral weight. The LCAO basis set is ideal for the unfolding method because the basis functions allocated to each atomic species are invariant regardless of the existence of surface and impurity. The unfolded spectral weight is well defined by the property of the LCAO basis functions. In exchange for the property, the non-orthogonality of the LCAO basis functions has to be taken into account. We show how the non-orthogonality can be properly incorporated in the general formula. As an illustration of the method, we calculate the dispersive quantized spectral weight of a ZrB2 slab and show strong spectral broadening in the out-of-plane direction, demonstrating the usefulness of the unfolding method.

  2. Unfolding method for first-principles LCAO electronic structure calculations.

    PubMed

    Lee, Chi-Cheng; Yamada-Takamura, Yukiko; Ozaki, Taisuke

    2013-08-28

    Unfolding the band structure of a supercell to a normal cell enables us to investigate how symmetry breakers such as surfaces and impurities perturb the band structure of the normal cell. We generalize the unfolding method, originally developed based on Wannier functions, to the linear combination of atomic orbitals (LCAO) method, and present a general formula to calculate the unfolded spectral weight. The LCAO basis set is ideal for the unfolding method because the basis functions allocated to each atomic species are invariant regardless of the existence of surface and impurity. The unfolded spectral weight is well defined by the property of the LCAO basis functions. In exchange for the property, the non-orthogonality of the LCAO basis functions has to be taken into account. We show how the non-orthogonality can be properly incorporated in the general formula. As an illustration of the method, we calculate the dispersive quantized spectral weight of a ZrB2 slab and show strong spectral broadening in the out-of-plane direction, demonstrating the usefulness of the unfolding method. PMID:23912816

  3. Structure and magnetism of bulk Fe and Cr: from plane waves to LCAO methods.

    PubMed

    Soulairol, R; Fu, Chu-Chun; Barreteau, C

    2010-07-28

    Magnetic, structural and energetic properties of bulk Fe and Cr were studied using first-principles calculations within density functional theory (DFT). We aimed to identify the dependence of these properties on key approximations of DFT, namely the exchange-correlation functional, the pseudopotential and the basis set. We found a smaller effect of pseudopotentials (PPs) on Fe than on Cr. For instance, the local magnetism of Cr was shown to be particularly sensitive to the potentials representing the core electrons, i.e. projector augmented wave and Vanderbilt ultrasoft PPs predict similar results, whereas standard norm-conserving PPs tend to overestimate the local magnetic moments of Cr in bcc Cr and in dilute bcc FeCr alloys. This drawback is suggested to be closely correlated to the overestimation of Cr solution energy in the latter system. On the other hand, we point out that DFT methods with very reduced localized basis sets (LCAO: linear combination of atomic orbitals) give satisfactory results compared with more robust plane-wave approaches. A minimal-basis representation of '3d' electrons comes to be sufficient to describe non-trivial magnetic phases including spin spirals in both fcc Fe and bcc Cr, as well as the experimental magnetic ground state of bcc Cr showing a spin density wave (SDW) state. In addition, a magnetic 'spd' tight binding model within the Stoner formalism was proposed and validated for Fe and Cr. The respective Stoner parameters were obtained by fitting to DFT data. This efficient semiempirical approach was shown to be accurate enough for studying various collinear and non-collinear phases of bulk Fe and Cr. It also enabled a detailed investigation of different polarization states of SDW in bcc Cr, where the longitudinal state was suggested to be the ground state, consistent with existing experimental data. PMID:21399309

  4. LCAO approximation for scaling properties of the Menger sponge fractal.

    PubMed

    Sakoda, Kazuaki

    2006-11-13

    The electromagnetic eigenmodes of a three-dimensional fractal called the Menger sponge were analyzed by the LCAO (linear combination of atomic orbitals) approximation and a first-principle calculation based on the FDTD (finite-difference time-domain) method. Due to the localized nature of the eigenmodes, the LCAO approximation gives a good guiding principle to find scaled eigenfunctions and to observe the approximate self-similarity in the spectrum of the localized eigenmodes. PMID:19529555

  5. Geometry and magnetic structure variation in manganese-oxide clusters determined by a self-consistent, LCAO method

    NASA Astrophysics Data System (ADS)

    Williams, Kristen; Hooper, Joseph

    2013-03-01

    Ab initio simulations are used to study the variation in geometry and magnetic structure in MnxOy (x = 3,4; y = 1,2) clusters. The groundstate wavefunctions for clusters with different magnetic coupling (ferromagnetic, ferrimagnetic and antiferromagnetic) are modeled with linear combinations of atomic orbitals (LCAOs). Self-consistent energies for different spin isomers are calculated by constraining the magnetic moments of Mn atoms constituting each basis AO. The ferrimagnetic and antiferromagnetic ground-state structures of MnxOy are 0.16-1.20 eV lower in energy than their ferromagnetic isomers. The presence of oxygen thus stabilizes low-spin isomers relative to the preferred high-spin ordering of bare Mn3 and Mn4. Each cluster has a preferred overall magnetic moment, and no evidence is seen of competing states with different spin multiplicities. However, non-degenerate isomags (clusters that possess the same spin multiplicity but different arrangements of local moments) do contribute to peak broadening observed in negative-ion photoelectron spectra. Proper accounting for all possible isomags is shown to be critical for accurate comparison with experimental spectra. Research was conducted at Naval Surface Warfare Center, Indian Head, MD and supported by the ONR NREIP program.

  6. Electronic properties of mixed molybdenum dichalcogenide MoTeSe: LCAO calculations and Compton spectroscopy

    NASA Astrophysics Data System (ADS)

    Ahuja, Ushma; Kumar, Kishor; Joshi, Ritu; Bhavsar, D. N.; Heda, N. L.

    2016-07-01

    We have employed linear combination of atomic orbitals (LCAO) method to compute the Mulliken's population (MP), energy bands, density of states (DOS) and Compton profiles for hexagonal MoTeSe. The density functional theory (DFT) and hybridization of Hartree-Fock with DFT (B3LYP) have been used within the LCAO approximation. Performance of theoretical models has been tested by comparing the theoretical momentum densities with the experimental Compton profile of MoTeSe measured using 137Cs Compton spectrometer. It is seen that the B3LYP prescription gives a better agreement with the experimental data than other DFT based approximations. The energy bands and DOS depict an indirect band gap character in MoTeSe. In addition, a relative nature of bonding in MoTeSe and its isovalent MoTe2 is discussed in terms of equal-valence-electron-density (EVED) profiles. On the basis of EVED profiles it is seen that MoTeSe is more covalent than MoTe2.

  7. One-electron diatomics in momentum space. II. Second and third iterated LCAO solutions

    SciTech Connect

    Koga, T.; Kawa-ai, R.

    1986-05-15

    Recurrence formulas are derived for the iterative LCAO solution of the one-electron two-center Schroedinger equation in the Fock representation. The results are applied to the second and third iterated LCAO solutions of the H/sup +//sub 2/ system at various internuclear distances R. For 0< or =R< or =20 (a.u.), the maximum errors in the electronic energy are reduced to 2.7% (second iterated) and 1.6% (third iterated), which should be compared with the previous errors of 28.2% (zeroth iterated) and 4.7% (first iterated).

  8. A Initio Lcao Electronic Structure Calculations of Layered Transition Metal Compounds.

    NASA Astrophysics Data System (ADS)

    Dawson, William G.

    1987-09-01

    Available from UMI in association with The British Library. In this work the electronic structure of three systems of layered transition metal compounds are examined using an ab initio tight binding (LCAO) method using the Xalpha exchange/correlation approximation: group VI ditellurides, group IV trichalcogenides and quaternary copper oxide defect-perovskites. A chemical pseudopotential argument is presented in order to justify the use of a small basis set of atomic orbitals. The group VI transition metal compounds MoTe_2 and WTe _2 show strong metal-metal interactions and MoTe_2 undergoes an unusual phase transition with the lattice parameter perpendicular to the layers decreasing with increasing temperature. The group IV transition metal trichalcogenides provide a useful series for study due to their quasi-1-dimensional character and the occurrence of two closely related structural variants. The atypical compound ZrTe_3 is given special attention because of its apparent semimetallic nature. The final group of compounds studied are the high Tc superconducting ceramics Ba-La-Cu-O and Ba-Y-Cu-O. The technological importance of compounds with zero resistance and showing the Meissner effect (expelling magnetic fields) above liquid nitrogen temperatures and the, as yet, undefined nature of the mechanism of superconductivity stresses the need to carefully examine the electronic structure of these materials. The role of oxygen vacancies, the charge state of the copper ions and the possibility of structural phase transitions are some of the topics considered here. The use of an atomic-orbital basis allows a comparatively straightforward description of the chemical bonding in a crystal--especially useful when the unit cell contains a large number of atoms.

  9. LCAO-local-spin-density calculations for V 2 and Mn 2

    NASA Astrophysics Data System (ADS)

    Salahub, D. R.; Baykara, N. A.

    1985-06-01

    Binding-energy curves for V 2 and Mn 2 have been obtained through spin-polarized, broken-symmetry LCAO-local-spin-density (LSD) calculations. For V 2 the region near Re is characterized by full-symmetry ( D∞h) molecular orbitals. The LSD ground state (configuration 1π 4u 1σ 2g 1δ 2g 2σ 2g) is a triplet with R e = 1.75 Å, ω e = 594 cm -1. There is a state with αβ spin about 0.4 eV higher. These results are in good agreement with recent beam spectroscopy experiments. The large- R part of the V 2 potential curve is, however, inaccurate since the molecule dissociates into two d 4s 1 atoms (the LSD ground state for a spherical V atom) rather than two ground-state (d 3s 2) atoms. For Mn 2 the magnetic aspects are more dominant; symmetry breaking is essential. We find a long ( R e = 2.52 Å), relatively weak ( De = 0.86 eV) bond with ωe = 144 cm-1, for an "antiferro magnetic" 1σ 2 1δ 4 1π 4 2σ 2 3σ 2 configuration. These results are in good agreement with experimental data, where available.

  10. [Estimation of protein binding by means of the HMO-LCAO-method (author's transl)].

    PubMed

    Schultz, O E; Gottfried, W

    1976-01-01

    Calculating the protein binding of six drug series the value sigma/sigma net charge/Mol turned out to be characteristic if the effects of substitutents were considered. Single- and multiple-substituted compounds were calculated in separate groups. For aliphatic-substituted compounds a classification resulted from the length of the substituted chain and from characteristic atoms. Substitution in 3- or 4-position made no significant differences. As an additional value sigma SAP/Mol may be applied to aromatic-substituted compounds. PMID:947164

  11. A first-principles DFT study of UN bulk and (001) surface: comparative LCAO and PW calculations.

    PubMed

    Evarestov, R A; Bandura, A V; Losev, M V; Kotomin, E A; Zhukovskii, Yu F; Bocharov, D

    2008-10-01

    LCAO and PW DFT calculations of the lattice constant, bulk modulus, cohesive energy, charge distribution, band structure, and DOS for UN single crystal are analyzed. It is demonstrated that a choice of the uranium atom relativistic effective core potentials considerably affects the band structure and magnetic structure at low temperatures. All calculations indicate mixed metallic-covalent chemical bonding in UN crystal with U5f states near the Fermi level. On the basis of the experience accumulated in UN bulk simulations, we compare the atomic and electronic structure as well as the formation energy for UN(001) surface calculated on slabs of different thickness using both DFT approaches. PMID:18496791

  12. All-electron LCAO calculations of the LiF crystal phonon spectrum: Influence of the basis set, the exchange-correlation functional, and the supercell size.

    PubMed

    Evarestov, R A; Losev, M V

    2009-12-01

    For the first time the convergence of the phonon frequencies and dispersion curves in terms of the supercell size is studied in ab initio frozen phonon calculations on LiF crystal. Helmann-Feynman forces over atomic displacements are found in all-electron calculations with the localized atomic functions (LCAO) basis using CRYSTAL06 program. The Parlinski-Li-Kawazoe method and FROPHO program are used to calculate the dynamical matrix and phonon frequencies of the supercells. For fcc lattice, it is demonstrated that use of the full supercell space group (including the supercell inner translations) enables to reduce essentially the number of the displacements under consideration. For Hartree-Fock (HF), PBE and hybrid PBE0, B3LYP, and B3PW exchange-correlation functionals the atomic basis set optimization is performed. The supercells up to 216 atoms (3 x 3 x 3 conventional unit cells) are considered. The phonon frequencies using the supercells of different size and shape are compared. For the commensurate with supercell k-points the best agreement of the theoretical results with the experimental data is found for B3PW exchange-correlation functional calculations with the optimized basis set. The phonon frequencies at the most non-commensurate k-points converged for the supercell consisting of 4 x 4 x 4 primitive cells and ensures the accuracy 1-2% in the thermodynamic properties calculated (the Helmholtz free energy, entropy, and heat capacity at the room temperature). PMID:19382176

  13. Lcao-Gáspár-Kohn-Sham energy bands of trans-polyacetylene-chain

    NASA Astrophysics Data System (ADS)

    von Boehm, J.; Kuivalainen, P.; Calais, J.-L.

    1983-12-01

    The band structure of the dimerised trans-polyacetylene-chain ( d CC = 1.35 Å, d CC = 1.46 Å, ∡ CCC = 120° , d CH = 1.09 Å) is calculated with the (parameter-free, non-self-consistent) linear-combination-of-atomic-orbitals method using the Gáspár-Kohn-Sham (GKS) potential for the exchange and correlation. The calculated dimerisation gap of 1.6 eV agrees closely with experiment and also with other GKS calculations when the degree of dimerisation is taken into account. The calculated density of states agrees closely with the X-ray photoemission spectrum of Brundle.

  14. Relativistic density functional calculations using two-spinor minimax finite-element method and linear combination of atomic orbitals for ZnO, CdO, HgO, UubO and Cu2, Ag2, Au2, Rg2.

    PubMed

    Kullie, O; Zhang, H; Kolb, J; Kolb, D

    2006-12-28

    In previous work the authors have presented a highly accurate two-spinor fully relativistic solution of the two-center Coulomb problem utilizing the finite-element method (FEM) and furthermore developed a relativistic minimax two-spinor linear combination of atomic orbitals (LCAO). In the present paper the authors present Dirac-Fock-Slater (DFS-) density functional calculations for two-atomic molecules up to super heavy systems using the fully nonlinear minimax FEM and the minimax LCAO in its linearized approximation (linear approximation to relativistic minimax). The FEM gives highly accurate benchmark results for the DFS functional. Especially considering molecules with up to super heavy atoms such as UubO and Rg2, the authors found that LCAO fails to give the correct systematic trends. The accurate FEM results shed a new light on the quality of the DFS-density functional. PMID:17199347

  15. A Parallel Iterative Method for Computing Molecular Absorption Spectra.

    PubMed

    Koval, Peter; Foerster, Dietrich; Coulaud, Olivier

    2010-09-14

    We describe a fast parallel iterative method for computing molecular absorption spectra within TDDFT linear response and using the LCAO method. We use a local basis of "dominant products" to parametrize the space of orbital products that occur in the LCAO approach. In this basis, the dynamic polarizability is computed iteratively within an appropriate Krylov subspace. The iterative procedure uses a matrix-free GMRES method to determine the (interacting) density response. The resulting code is about 1 order of magnitude faster than our previous full-matrix method. This acceleration makes the speed of our TDDFT code comparable with codes based on Casida's equation. The implementation of our method uses hybrid MPI and OpenMP parallelization in which load balancing and memory access are optimized. To validate our approach and to establish benchmarks, we compute spectra of large molecules on various types of parallel machines. The methods developed here are fairly general, and we believe they will find useful applications in molecular physics/chemistry, even for problems that are beyond TDDFT, such as organic semiconductors, particularly in photovoltaics. PMID:26616067

  16. LCAO-based theoretical study of PbTiO3 crystal to search for parity and time reversal violating interaction in solids

    NASA Astrophysics Data System (ADS)

    Skripnikov, L. V.; Titov, A. V.

    2016-08-01

    An experiment towards the search for the interaction of the Schiff moment (S) of the 207Pb nuclei with electrons in PbTiO3 crystal which violates the time reversal (T) and space parity (P) symmetries was proposed by Mukhamedjanov and Sushkov [Phys. Rev. A 72, 034501 (2005)]. The interpretation of the experiment in terms of the Schiff moment requires knowledge of an electronic density gradient parameter (usually designated as X) on the Pb nucleus in the crystal, which is determined by the electronic structure of the crystal. Here we propose a theoretical approach to calculate the properties in solids which are directly sensitive to the changes of valence electron densities in atomic cores but not in the valence spatial regions (Mössbauer parameters, hyperfine structure (HFS) constants, parameters of T,P-odd Hamiltonians, etc. [L. V. Skripnikov and A. V. Titov, Phys. Rev. A 91, 042504 (2015)]). It involves constructing the crystalline orbitals via the linear combination of atomic orbitals and employs a two-step concept of calculating such properties that was earlier proposed by us for the case of heavy-atom molecules. The application of the method to the PbTiO3 crystal results in the energy shift, Δ ɛ = 0 . 82 × 1 0 6 /S ( 207 Pb ) e aB 3 eV , due to the T,P-odd interactions. The value is compared to the corresponding parameter in diatomic molecules (TlF, RaO, PbO), which have been proposed and used in the past decades in the search for the nuclear Schiff moment. We also present the calculation of the electric field gradient at the Pb nucleus in PbTiO3 for the comparison with other solid-state electronic structure approaches.

  17. LCAO-based theoretical study of PbTiO3 crystal to search for parity and time reversal violating interaction in solids.

    PubMed

    Skripnikov, L V; Titov, A V

    2016-08-01

    An experiment towards the search for the interaction of the Schiff moment (S) of the (207)Pb nuclei with electrons in PbTiO3 crystal which violates the time reversal (T) and space parity (P) symmetries was proposed by Mukhamedjanov and Sushkov [Phys. Rev. A 72, 034501 (2005)]. The interpretation of the experiment in terms of the Schiff moment requires knowledge of an electronic density gradient parameter (usually designated as X) on the Pb nucleus in the crystal, which is determined by the electronic structure of the crystal. Here we propose a theoretical approach to calculate the properties in solids which are directly sensitive to the changes of valence electron densities in atomic cores but not in the valence spatial regions (Mössbauer parameters, hyperfine structure (HFS) constants, parameters of T,P-odd Hamiltonians, etc. [L. V. Skripnikov and A. V. Titov, Phys. Rev. A 91, 042504 (2015)]). It involves constructing the crystalline orbitals via the linear combination of atomic orbitals and employs a two-step concept of calculating such properties that was earlier proposed by us for the case of heavy-atom molecules. The application of the method to the PbTiO3 crystal results in the energy shift, Δε=0.82×10(6)S((207)Pb)eaB (3)eV, due to the T,P-odd interactions. The value is compared to the corresponding parameter in diatomic molecules (TlF, RaO, PbO), which have been proposed and used in the past decades in the search for the nuclear Schiff moment. We also present the calculation of the electric field gradient at the Pb nucleus in PbTiO3 for the comparison with other solid-state electronic structure approaches. PMID:27497547

  18. The Fourier transform method and the SD-bar approach for the analytical and numerical treatment of multicenter overlap-like quantum similarity integrals

    SciTech Connect

    Safouhi, Hassan . E-mail: hassan.safouhi@ualberta.ca; Berlu, Lilian

    2006-07-20

    Molecular overlap-like quantum similarity measurements imply the evaluation of overlap integrals of two molecular electronic densities related by Dirac delta function. When the electronic densities are expanded over atomic orbitals using the usual LCAO-MO approach (linear combination of atomic orbitals), overlap-like quantum similarity integrals could be expressed in terms of four-center overlap integrals. It is shown that by introducing the Fourier transform of delta Dirac function in the integrals and using the Fourier transform approach combined with the so-called B functions, one can obtain analytic expressions of the integrals under consideration. These analytic expressions involve highly oscillatory semi-infinite spherical Bessel functions, which are the principal source of severe numerical and computational difficulties. In this work, we present a highly efficient algorithm for a fast and accurate numerical evaluation of these multicenter overlap-like quantum similarity integrals over Slater type functions. This algorithm is based on the SD-bar approach due to Safouhi. Recurrence formulae are used for a better control of the degree of accuracy and for a better stability of the algorithm. The numerical result section shows the efficiency of our algorithm, compared with the alternatives using the one-center two-range expansion method, which led to very complicated analytic expressions, the epsilon algorithm and the nonlinear D-bar transformation.

  19. Newton's method

    SciTech Connect

    More, J. J.; Sorensen, D. C.

    1982-02-01

    Newton's method plays a central role in the development of numerical techniques for optimization. In fact, most of the current practical methods for optimization can be viewed as variations on Newton's method. It is therefore important to understand Newton's method as an algorithm in its own right and as a key introduction to the most recent ideas in this area. One of the aims of this expository paper is to present and analyze two main approaches to Newton's method for unconstrained minimization: the line search approach and the trust region approach. The other aim is to present some of the recent developments in the optimization field which are related to Newton's method. In particular, we explore several variations on Newton's method which are appropriate for large scale problems, and we also show how quasi-Newton methods can be derived quite naturally from Newton's method.

  20. Sonofluorescence method

    NASA Astrophysics Data System (ADS)

    Li, Huamao

    1998-11-01

    In this paper, a new sonofluorescence method is proposed. Based upon the method, the author has obtained the sonofluorescence emission spectrum of an aqueous luminol- NaOH solution, and displayed the cavitation field distribution in a sonochemical glass reactor.

  1. Lattice dynamics of α-TeO2 in the DFT-LCAO-B3LYP approximation

    NASA Astrophysics Data System (ADS)

    Ivanova, T. A.; Mavrin, B. N.

    2015-11-01

    Ab initio DFT analysis of phonon frequencies at the center of the Brillouin zone, dispersion of phonons, phonon state density, effective Born charges, and IR reflection and Raman spectra of α-TeO2 is performed in the basis set of Gaussian functions using the hybrid B3LYP pseudopotential. Inverted phonons were discovered in the TO-LO splitting of polar modes. The possibility of assigning the frequencies to vibrations of the TeO2 molecule is discussed. The anisotropy of effective Born charges is explained to be a result of the ion-covalent character of the Te-O bond.

  2. RESISTIVITY METHODS

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Resistivity methods were among the first geophysical techniques developed. The basic concept originated with Conrad Schlumberger, who conducted the initial resistivity field tests in Normandy, France during 1912. The resistivity method, employed in its earliest and most conventional form, uses an ex...

  3. Electrodeionization method

    DOEpatents

    Lin, YuPo J.; Hestekin, Jamie; Arora, Michelle; St. Martin, Edward J.

    2004-09-28

    An electrodeionization method for continuously producing and or separating and/or concentrating ionizable organics present in dilute concentrations in an ionic solution while controlling the pH to within one to one-half pH unit method for continuously producing and or separating and/or concentrating ionizable organics present in dilute concentrations in an ionic solution while controlling the pH to within one to one-half pH unit.

  4. Ensemble Methods

    NASA Astrophysics Data System (ADS)

    Re, Matteo; Valentini, Giorgio

    2012-03-01

    Ensemble methods are statistical and computational learning procedures reminiscent of the human social learning behavior of seeking several opinions before making any crucial decision. The idea of combining the opinions of different "experts" to obtain an overall “ensemble” decision is rooted in our culture at least from the classical age of ancient Greece, and it has been formalized during the Enlightenment with the Condorcet Jury Theorem[45]), which proved that the judgment of a committee is superior to those of individuals, provided the individuals have reasonable competence. Ensembles are sets of learning machines that combine in some way their decisions, or their learning algorithms, or different views of data, or other specific characteristics to obtain more reliable and more accurate predictions in supervised and unsupervised learning problems [48,116]. A simple example is represented by the majority vote ensemble, by which the decisions of different learning machines are combined, and the class that receives the majority of “votes” (i.e., the class predicted by the majority of the learning machines) is the class predicted by the overall ensemble [158]. In the literature, a plethora of terms other than ensembles has been used, such as fusion, combination, aggregation, and committee, to indicate sets of learning machines that work together to solve a machine learning problem [19,40,56,66,99,108,123], but in this chapter we maintain the term ensemble in its widest meaning, in order to include the whole range of combination methods. Nowadays, ensemble methods represent one of the main current research lines in machine learning [48,116], and the interest of the research community on ensemble methods is witnessed by conferences and workshops specifically devoted to ensembles, first of all the multiple classifier systems (MCS) conference organized by Roli, Kittler, Windeatt, and other researchers of this area [14,62,85,149,173]. Several theories have been

  5. Ensemble Methods

    NASA Astrophysics Data System (ADS)

    Re, Matteo; Valentini, Giorgio

    2012-03-01

    Ensemble methods are statistical and computational learning procedures reminiscent of the human social learning behavior of seeking several opinions before making any crucial decision. The idea of combining the opinions of different "experts" to obtain an overall “ensemble” decision is rooted in our culture at least from the classical age of ancient Greece, and it has been formalized during the Enlightenment with the Condorcet Jury Theorem[45]), which proved that the judgment of a committee is superior to those of individuals, provided the individuals have reasonable competence. Ensembles are sets of learning machines that combine in some way their decisions, or their learning algorithms, or different views of data, or other specific characteristics to obtain more reliable and more accurate predictions in supervised and unsupervised learning problems [48,116]. A simple example is represented by the majority vote ensemble, by which the decisions of different learning machines are combined, and the class that receives the majority of “votes” (i.e., the class predicted by the majority of the learning machines) is the class predicted by the overall ensemble [158]. In the literature, a plethora of terms other than ensembles has been used, such as fusion, combination, aggregation, and committee, to indicate sets of learning machines that work together to solve a machine learning problem [19,40,56,66,99,108,123], but in this chapter we maintain the term ensemble in its widest meaning, in order to include the whole range of combination methods. Nowadays, ensemble methods represent one of the main current research lines in machine learning [48,116], and the interest of the research community on ensemble methods is witnessed by conferences and workshops specifically devoted to ensembles, first of all the multiple classifier systems (MCS) conference organized by Roli, Kittler, Windeatt, and other researchers of this area [14,62,85,149,173]. Several theories have been

  6. Electronic structure of polycrystalline Cd metal using 241Am radioisotope

    NASA Astrophysics Data System (ADS)

    Dhaka, M. S.; Sharma, G.; Mishra, M. C.; Sharma, B. K.

    2014-04-01

    Electronic structure study of the polycrystalline cadmium metal is reported. The experimental measurement is undertaken on a polycrystalline sheet sample using 59.54 keV radioisotope of 241Am. These results are compared with the ab initio calculations. The theoretical calculations are performed using linear combination of atomic orbitals (LCAO) method employing the density functional theories (DFT) and Hartree-Fock (HF) and augmented plane wave (APW) methods. The spherically averaged APW and LCAO based theoretical Compton profiles are in good agreement with the experimental measurement however the APW based theoretical calculations show best agreement.

  7. Electronic structure of polycrystalline Cd metal using {sup 241}Am radioisotope

    SciTech Connect

    Dhaka, M. S.; Sharma, G.; Mishra, M. C.; Sharma, B. K.

    2014-04-24

    Electronic structure study of the polycrystalline cadmium metal is reported. The experimental measurement is undertaken on a polycrystalline sheet sample using 59.54 keV radioisotope of {sup 241}Am. These results are compared with the ab initio calculations. The theoretical calculations are performed using linear combination of atomic orbitals (LCAO) method employing the density functional theories (DFT) and Hartree-Fock (HF) and augmented plane wave (APW) methods. The spherically averaged APW and LCAO based theoretical Compton profiles are in good agreement with the experimental measurement however the APW based theoretical calculations show best agreement.

  8. Characterization methods

    SciTech Connect

    Glass, J.T.

    1993-01-01

    Methods discussed in this compilation of notes and diagrams are Raman spectroscopy, scanning electron microscopy, transmission electron microscopy, and other surface analysis techniques (auger electron spectroscopy, x-ray photoelectron spectroscopy, electron energy loss spectroscopy, and scanning tunnelling microscopy). A comparative evaluation of different techniques is performed. In-vacuo and in-situ analyses are described.

  9. COATING METHOD

    DOEpatents

    Townsend, R.G.

    1959-08-25

    A method is described for protectively coating beryllium metal by etching the metal in an acid bath, immersing the etched beryllium in a solution of sodium zincate for a brief period of time, immersing the beryllium in concentrated nitric acid, immersing the beryhlium in a second solution of sodium zincate, electroplating a thin layer of copper over the beryllium, and finally electroplating a layer of chromium over the copper layer.

  10. Drilling method

    SciTech Connect

    Stokley, C.O.; Haas, R.C.

    1991-04-30

    This patent describes a drilling method. It includes: rotating a drill bit in a well head to drill a well in an earth formation while circulating drilling fluid consisting essentially of a liquid; conducting the returning drilling fluid, and oil and gas from the formation to a flow rate control valve and to a pressure control valve; and conducting fluid from the flow rate control valve and the pressure control valve to a separator vessel maintained under pressure.

  11. SINTERING METHOD

    DOEpatents

    Googin, J.M.

    1963-11-01

    Methods of making articles by powder metallurgy techniques are presented. An article is made by packing a metal powder into a desired shape, raising the temperature of the powder compact to a sintering temperature in the presence of a reducing gas, and alternately increasing and decreasing the pressure of the gas while the temperatume is being raised. The product has a greater density than can be achieved by sintering for the same length of time at a constant gas pressure. (AEC)

  12. Genotyping methods.

    PubMed

    Tümmler, Burkhard

    2014-01-01

    Genotyping allows for the identification of bacterial isolates to the strain level and provides basic information about the evolutionary biology, population biology, taxonomy, ecology, and genetics of bacteria. Depending on the underlying question and available resources, Pseudomonas aeruginosa strains may be typed by anonymous fingerprinting techniques or electronically portable sequence-based typing methods such as multiple locus variable number tandem repeat (VNTR) analysis (MLVA), multilocus sequence typing, or oligonucleotide microarray. Macrorestriction fragment pattern analysis is a genotyping method that is globally applicable to all bacteria and hence has been and still is the reference method for strain typing in bacteriology. Agarose-embedded chromosomal DNA is cleaved with a rare-cutting restriction endonuclease and the generated 20-70 fragments are then separated by pulsed-field gel electrophoresis. The chapter provides a detailed step-by-step manual for SpeI genome fingerprinting of Pseudomonas chromosomes that has been optimized for SpeI fragment pattern analysis of P. aeruginosa. PMID:24818895

  13. Gelcasting methods

    DOEpatents

    Walls, Claudia A.; Kirby, Glen H.; Janney, Mark A.; Omatete, Ogbemi O.; Nunn, Stephen D.; McMillan, April D.

    2000-01-01

    A method of gelcasting includes the steps of providing a solution of at least hydroxymethylacrylamide (HMAM) and water. At least one inorganic powder is added to the mixture. At least one initiator system is provided to polymerize the HMAM. The initiator polymerizes the HMAM and water, to form a firm hydrogel that contains the inorganic powder. One or more comonomers can be polymerized with the HMAM monomer, to alter the final properties of the gelcast material. Additionally, one or more additives can be included in the polymerization mixture, to alter the properties of the gelcast material.

  14. Electronic structure and electron momentum density in TiSi

    NASA Astrophysics Data System (ADS)

    Ghaleb, A. M.; Mohammad, F. M.; Sahariya, Jagrati; Sharma, Mukesh; Ahuja, B. L.

    2013-03-01

    We report the electron momentum density in titanium monosilicide using 241Am Compton spectrometer. Experimental Compton profile has been compared with the theoretical profiles computed using linear combination of atomic orbitals (LCAO). The energy bands, density of states and Fermi surface structures of TiSi are reported using the LCAO and the full potential linearized augmented plane wave methods. Theoretical anisotropies in directional Compton profiles are interpreted in terms of energy bands. To confirm the conducting behavior, we also report the real space analysis of experimental Compton profile of TiSi.

  15. Electronic structure of Ni2TiAl: Theoretical aspects and Compton scattering measurement

    NASA Astrophysics Data System (ADS)

    Sahariya, Jagrati; Ahuja, B. L.

    2012-11-01

    In this paper, we report electron momentum density of Ni2TiAl alloy using an in-house 20 Ci 137Cs (661.65 keV) Compton spectrometer. The experimental data have been analyzed in terms of energy bands and density of states computed using linear combination of atomic orbitals (LCAO) method. In the LCAO computations, we have considered local density approximation, generalized gradient approximation and recently developed second order generalized gradient approximation within the frame work of density functional theory. Anisotropies in theoretical Compton profiles along [1 0 0], [1 1 0] and [1 1 1] directions are also explained in terms of energy bands.

  16. Electronic structure of CdMoO4 using Compton scattering technique

    NASA Astrophysics Data System (ADS)

    Sharma, Khushboo; Sahariya, Jagrati; Ahuja, B. L.

    2014-04-01

    The first ever Compton profile of polycrystalline CdMoO4 has been measured using 137Cs spectrometer. The results are compared with theoretical Compton profiles deduced from free atom and linear combination of atomic orbitals (LCAO) methods. We have also computed the energy bands using density functional theory (DFT) within LCAO. The computed bands confirm the semiconducting behaviour of this compound. It is seen that the DFT theoretical profile (with local density approximation) gives a better agreement with the experimental Compton data than free atom Compton profile.

  17. QSAR Methods.

    PubMed

    Gini, Giuseppina

    2016-01-01

    In this chapter, we introduce the basis of computational chemistry and discuss how computational methods have been extended to some biological properties and toxicology, in particular. Since about 20 years, chemical experimentation is more and more replaced by modeling and virtual experimentation, using a large core of mathematics, chemistry, physics, and algorithms. Then we see how animal experiments, aimed at providing a standardized result about a biological property, can be mimicked by new in silico methods. Our emphasis here is on toxicology and on predicting properties through chemical structures. Two main streams of such models are available: models that consider the whole molecular structure to predict a value, namely QSAR (Quantitative Structure Activity Relationships), and models that find relevant substructures to predict a class, namely SAR. The term in silico discovery is applied to chemical design, to computational toxicology, and to drug discovery. We discuss how the experimental practice in biological science is moving more and more toward modeling and simulation. Such virtual experiments confirm hypotheses, provide data for regulation, and help in designing new chemicals. PMID:27311459

  18. Casting methods

    DOEpatents

    Marsden, Kenneth C.; Meyer, Mitchell K.; Grover, Blair K.; Fielding, Randall S.; Wolfensberger, Billy W.

    2012-12-18

    A casting device includes a covered crucible having a top opening and a bottom orifice, a lid covering the top opening, a stopper rod sealing the bottom orifice, and a reusable mold having at least one chamber, a top end of the chamber being open to and positioned below the bottom orifice and a vacuum tap into the chamber being below the top end of the chamber. A casting method includes charging a crucible with a solid material and covering the crucible, heating the crucible, melting the material, evacuating a chamber of a mold to less than 1 atm absolute through a vacuum tap into the chamber, draining the melted material into the evacuated chamber, solidifying the material in the chamber, and removing the solidified material from the chamber without damaging the chamber.

  19. Tensiometer methods

    DOEpatents

    Grover, Blair K.; Hubbell, Joel M.; Sisson, James B.; Casper, William L.

    2005-12-20

    A method for collecting data regarding a matric potential of a media includes providing a tensiometer having a stainless steel tensiometer casing, the stainless steel tensiometer casing comprising a tip portion which includes a wetted porous stainless steel membrane through which a matric potential of a media is sensed; driving the tensiometer into the media using an insertion tube comprising a plurality of probe casing which are selectively coupled to form the insertion tube as the tensiometer is progressively driven deeper into the media, wherein the wetted porous stainless steel membrane is in contact with the media; and sensing the matric potential the media exerts on the wetted porous stainless steel membrane by a pressure sensor in fluid hydraulic connection with the porous stainless steel membrane. A tensiometer includes a stainless steel casing.

  20. WELDING METHOD

    DOEpatents

    Cornell, A.A.; Dunbar, J.V.; Ruffner, J.H.

    1959-09-29

    A semi-automatic method is described for the weld joining of pipes and fittings which utilizes the inert gasshielded consumable electrode electric arc welding technique, comprising laying down the root pass at a first peripheral velocity and thereafter laying down the filler passes over the root pass necessary to complete the weld by revolving the pipes and fittings at a second peripheral velocity different from the first peripheral velocity, maintaining the welding head in a fixed position as to the specific direction of revolution, while the longitudinal axis of the welding head is disposed angularly in the direction of revolution at amounts between twenty minutas and about four degrees from the first position.

  1. Translation and integration of numerical atomic orbitals in linear molecules.

    PubMed

    Heinäsmäki, Sami

    2014-02-14

    We present algorithms for translation and integration of atomic orbitals for LCAO calculations in linear molecules. The method applies to arbitrary radial functions given on a numerical mesh. The algorithms are based on pseudospectral differentiation matrices in two dimensions and the corresponding two-dimensional Gaussian quadratures. As a result, multicenter overlap and Coulomb integrals can be evaluated effectively. PMID:24527905

  2. Translation and integration of numerical atomic orbitals in linear molecules

    NASA Astrophysics Data System (ADS)

    Heinäsmäki, Sami

    2014-02-01

    We present algorithms for translation and integration of atomic orbitals for LCAO calculations in linear molecules. The method applies to arbitrary radial functions given on a numerical mesh. The algorithms are based on pseudospectral differentiation matrices in two dimensions and the corresponding two-dimensional Gaussian quadratures. As a result, multicenter overlap and Coulomb integrals can be evaluated effectively.

  3. A Simple Demonstration of Atomic and Molecular Orbitals Using Circular Magnets

    ERIC Educational Resources Information Center

    Chakraborty, Maharudra; Mukhopadhyay, Subrata; Das, Ranendu Sekhar

    2014-01-01

    A quite simple and inexpensive technique is described here to represent the approximate shapes of atomic orbitals and the molecular orbitals formed by them following the principles of the linear combination of atomic orbitals (LCAO) method. Molecular orbitals of a few simple molecules can also be pictorially represented. Instructors can employ the…

  4. Implementation of a vector potential method in an ab initio Hartree-Fock code

    NASA Astrophysics Data System (ADS)

    Tevekeliyska, Violina; Springborg, Michael; Champagne, Benoît; Kirtman, Bernard

    2012-12-01

    For extended systems exposed to an external, electrostatic field, the presence of the field leads to an extra term (E⃗. P⃗) to the Hamiltonian, where E⃗ is the field vector and P⃗ is the polarization of the system of interest. In order to find out how a polymer chain responds to an external electric perturbation, a field with a charge and a current term for the polarization is added to an ab initio Hartree-Fock Hamiltonian. The polarization expression is taken from an efficient vector potential approach (VPA) [1] for calculating electronic and nuclear responses of infinite periodic systems to finite electric fields and is implemented in the ab initio LCAO-SCF algorithm [3], which computes band structure of regular or helical polymers, taking into account the one-dimensional translational symmetry. A smoothing procedure for numerical differentiation of the orbital coefficients is used in order to calculate self-consistently the charge flow contribution to the polarization.

  5. Simulations of the Structure and Properties of Large Icosahedral Boron Clusters Based on a Novel Semi-Empirical Hamiltonian

    NASA Astrophysics Data System (ADS)

    Tandy, Paul; Yu, Ming; Jayanthi, C. S.; Wu, Shi-Yu; Condensed Matter Theory Group Team

    2013-03-01

    A successful development of a parameterized semi-empirical Hamiltonian (SCED-LCAO) for boron based on a LCAO framework using a sp3 basis set will be discussed. The semi-empirical Hamiltonian contains environment-dependency and electron screening effects of a many-body Hamiltonian and allows for charge self-consistency. We have optimized the parameters of the SCED-LCAO Hamiltonian for boron by fitting the properties (e.g., the binding energy, bond length, etc.) of boron sheets, small clusters and boron alpha to first-principles calculations based on DFT calculations. Although extended phases of boron alpha and beta have been studied, large clusters of boron with icosahedral structures such as those cut from boron alpha are difficult if not impossible to simulate with ab initio methods. We will demonstrate the effectiveness of the SCED-LCAO Hamiltonian in studying icosahedral boron clusters containing up to 800 atoms and will report on some novel boron clusters and computational speed. Support has been provided by the Dillion Fellowship.

  6. The Multidimensional WKB Method.

    ERIC Educational Resources Information Center

    Knudson, Stephen K.; Noid, D. W.

    1989-01-01

    Discusses a new method for determining the eigenvalues of the Schroedinger equation when the potential energy function does not have a simple form. Describes the mathematical methods and provides an application. Lists limitations to the method. (MVL)

  7. From Method to Post Method: A Panacea!

    ERIC Educational Resources Information Center

    Masouleh, Nima Shakouri

    2012-01-01

    The foundation of language teaching has undergone many changes. The rise and fall of language teaching methods depends upon a variety of factors extrinsic to a method itself and often reflects the influence of profit-seekers and promoters, as well as the forces of the intellectual marketplace. There was always a source of contention among people…

  8. Uranium price forecasting methods

    SciTech Connect

    Fuller, D.M.

    1994-03-01

    This article reviews a number of forecasting methods that have been applied to uranium prices and compares their relative strengths and weaknesses. The methods reviewed are: (1) judgemental methods, (2) technical analysis, (3) time-series methods, (4) fundamental analysis, and (5) econometric methods. Historically, none of these methods has performed very well, but a well-thought-out model is still useful as a basis from which to adjust to new circumstances and try again.

  9. The Moore Method

    ERIC Educational Resources Information Center

    Jones, F. Burton

    1977-01-01

    The Moore methods, in which college mathematics students prove theorems for themselves, is described. Difficulties and drawbacks to this method, appropriate areas of mathematics in which the Moore method can be used, and techniques in using the method are discussed. (DT)

  10. Designing ROW Methods

    NASA Technical Reports Server (NTRS)

    Freed, Alan D.

    1996-01-01

    There are many aspects to consider when designing a Rosenbrock-Wanner-Wolfbrandt (ROW) method for the numerical integration of ordinary differential equations (ODE's) solving initial value problems (IVP's). The process can be simplified by constructing ROW methods around good Runge-Kutta (RK) methods. The formulation of a new, simple, embedded, third-order, ROW method demonstrates this design approach.

  11. Failure combination method

    SciTech Connect

    Hedin, F.; Le Coguiec, A.; Le Floch, C.; Llory, M.; Villemeur, A.

    1981-01-01

    The method described in this paper is an inductive method for combining failures (called the Failure Combination Method (FCM)). It is based on a preliminary analysis of the systems performed with an FMEA. As a study has been undertaken to test the method, the organization of the study as well as its first results from a methodological point of view are stressed. 8 refs.

  12. Radiochemical method development

    SciTech Connect

    Erickson, M.D.; Aldstadt, J.H.; Alvarado, J.S.; Crain, J.S.; Orlandini, K.A.; Smith, L.L.

    1994-09-01

    The authors have developed methods for chemical characterization of the environment under a multitask project that focuses on improvement of radioanalytical methods with an emphasis on faster and cheaper routine methods. The authors have developed improved methods for separation of environmental levels of technetium-99, radium, and actinides from soil and water; separation of actinides from soil and water matrix interferences; and isolation of strontium. They are also developing methods for simultaneous detection of multiple isotopes (including nonradionuclides) by using a new instrumental technique, inductively coupled plasma-mass spectrometry (ICP-MS). The new ICP-MS methods have greater sensitivity and efficiency and could replace many radiometric techniques. They are using flow injection analysis to integrate and automate the separation methods with the ICP-MS methodology. The final product of all activities will be methods that are available (published in the U.S. Department of Energy`s analytical methods compendium) and acceptable for use in regulatory situations.

  13. Electromagnetic induction methods

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Electromagnetic induction geophysical methods are finding greater and greater use for agricultural purposes. Electromagnetic induction methods measure the electrical conductivity (or resistivity) for a bulk volume of soil directly beneath the surface. An instrument called a ground conductivity meter...

  14. Selecting Needs Analysis Methods.

    ERIC Educational Resources Information Center

    Newstrom, John W.; Lilyquist, John M.

    1979-01-01

    Presents a contingency model for decision making with regard to needs analysis methods. Focus is on 12 methods with brief discussion of their defining characteristics and some operational guidelines for their use. (JOW)

  15. Equations and closure methods

    NASA Technical Reports Server (NTRS)

    1977-01-01

    Basic differential equations governing compressible turbulent boundary layer flow are reviewed, including conservation of mass and energy, momentum equations derived from Navier-Stokes equations, and equations of state. Closure procedures were broken down into: (1) simple or zeroth-order methods, (2) first-order or mean field closure methods, and (3) second-order or mean turbulence field methods.

  16. Redefining the "Scientific Method".

    ERIC Educational Resources Information Center

    Spiece, Kelly R.; Colosi, Joseph

    2000-01-01

    Surveys 15 introductory biology textbooks for their presentation of the scientific method. Teaching the scientific method involves more than simplified steps and subjectivity--human politics, cultural influences, and chance are all a part of science. Presents an activity for students to experience the scientific method. (Contains 34 references.)…

  17. Geobacteraceae strains and methods

    DOEpatents

    Lovley, Derek R.; Nevin, Kelly P.; Yi, Hana

    2015-07-07

    Embodiments of the present invention provide a method of producing genetically modified strains of electricigenic microbes that are specifically adapted for the production of electrical current in microbial fuel cells, as well as strains produced by such methods and fuel cells using such strains. In preferred embodiments, the present invention provides genetically modified strains of Geobacter sulfurreducens and methods of using such strains.

  18. Space methods in oceanology

    NASA Technical Reports Server (NTRS)

    Bolshakov, A. A.

    1985-01-01

    The study of Earth from space with specialized satellites, and from manned orbiting stations, has become important in the space programs. The broad complex of methods used for probing Earth from space are different methods of the study of ocean, dynamics. The different methods of ocean observation are described.

  19. Methods in human cytogenetics

    SciTech Connect

    1993-12-31

    Chapter 4, discusses the various techniques used in the study human cytogenetics. The methods are discussed in historical order, from direct methods to tissue culture techniques, prenatal studies, meiotic studies, sex chromatin techniques, banding techniques, prophase banding and replication studies. Nomenclature of human chromosomes and quantitative methods are also mentioned. 60 refs., 3 figs.

  20. Accelerated molecular dynamics methods

    SciTech Connect

    Perez, Danny

    2011-01-04

    The molecular dynamics method, although extremely powerful for materials simulations, is limited to times scales of roughly one microsecond or less. On longer time scales, dynamical evolution typically consists of infrequent events, which are usually activated processes. This course is focused on understanding infrequent-event dynamics, on methods for characterizing infrequent-event mechanisms and rate constants, and on methods for simulating long time scales in infrequent-event systems, emphasizing the recently developed accelerated molecular dynamics methods (hyperdynamics, parallel replica dynamics, and temperature accelerated dynamics). Some familiarity with basic statistical mechanics and molecular dynamics methods will be assumed.

  1. An extended Lagrangian method

    NASA Technical Reports Server (NTRS)

    Liou, Meng-Sing

    1992-01-01

    A unique formulation of describing fluid motion is presented. The method, referred to as 'extended Lagrangian method', is interesting from both theoretical and numerical points of view. The formulation offers accuracy in numerical solution by avoiding numerical diffusion resulting from mixing of fluxes in the Eulerian description. Meanwhile, it also avoids the inaccuracy incurred due to geometry and variable interpolations used by the previous Lagrangian methods. Unlike the Lagrangian method previously imposed which is valid only for supersonic flows, the present method is general and capable of treating subsonic flows as well as supersonic flows. The method proposed in this paper is robust and stable. It automatically adapts to flow features without resorting to clustering, thereby maintaining rather uniform grid spacing throughout and large time step. Moreover, the method is shown to resolve multi-dimensional discontinuities with a high level of accuracy, similar to that found in one-dimensional problems.

  2. Extremely localized nonorthogonal orbitals by the pairing theorem.

    PubMed

    Zoboki, T; Mayer, I

    2011-03-01

    Using the concepts of Löwdin pairing theorem, a method is developed to calculate extremely localized, but nonorthogonal, sets of molecular orbitals and their strictly localized counterparts. The method is very suitable to study to what extent a given model of bonding in a given molecule can be considered adequate from the point of view of the actual LCAO-MO (Hartree Fock or DFT) wave function and is expected to be useful for doing local approximations of electron correlation. PMID:20941738

  3. Spin splitting in bulk wurtzite AlN under biaxial strain

    NASA Astrophysics Data System (ADS)

    Kao, Hsiu-Fen; Lo, Ikai; Chiang, Jih-Chen; Lee, Meng-En; Wu, C. L.; Wang, W. T.; Chen, Chun-Nan; Hsu, Y. C.

    2012-05-01

    The spin-splitting energies in biaxially strained bulk wurtzite material AlN are calculated using the linear combination of atomic orbital (LCAO) method, and the equi-spin-splitting distributions in k-space near the minimum-spin-splitting (MSS) surfaces are illustrated. These data are compared with those derived analytically by two-band k . p (2KP) model. It is found that the results from these two methods are in good agreement for small k. However, the ellipsoidal MSS surface under biaxial compressive strain does not exist in the 2KP model, because the data points are far from the Γ point. Instead, three basic shapes of the MSS surface occur in the wurtzite Brillouin zone: a hyperboloid of two sheets, a hexagonal cone, and a hyperboloid of one sheet, evaluated from the LCAO method across the range of biaxial strains from compressive to tensile.

  4. An extended Lagrangian method

    NASA Technical Reports Server (NTRS)

    Liou, Meng-Sing

    1993-01-01

    A unique formulation of describing fluid motion is presented. The method, referred to as 'extended Lagrangian method', is interesting from both theoretical and numerical points of view. The formulation offers accuracy in numerical solution by avoiding numerical diffusion resulting from mixing of fluxes in the Eulerian description. Meanwhile, it also avoids the inaccuracy incurred due to geometry and variable interpolations used by the previous Lagrangian methods. The present method is general and capable of treating subsonic flows as well as supersonic flows. The method proposed in this paper is robust and stable. It automatically adapts to flow features without resorting to clustering, thereby maintaining rather uniform grid spacing throughout and large time step. Moreover, the method is shown to resolve multidimensional discontinuities with a high level of accuracy, similar to that found in 1D problems.

  5. [Medical Equipment Maintenance Methods].

    PubMed

    Liu, Hongbin

    2015-09-01

    Due to the high technology and the complexity of medical equipment, as well as to the safety and effectiveness, it determines the high requirements of the medical equipment maintenance work. This paper introduces some basic methods of medical instrument maintenance, including fault tree analysis, node method and exclusive method which are the three important methods in the medical equipment maintenance, through using these three methods for the instruments that have circuit drawings, hardware breakdown maintenance can be done easily. And this paper introduces the processing methods of some special fault conditions, in order to reduce little detours in meeting the same problems. Learning is very important for stuff just engaged in this area. PMID:26904890

  6. Methods of Voice Reconstruction

    PubMed Central

    Chen, Hung-Chi; Kim Evans, Karen F.; Salgado, Christopher J.; Mardini, Samir

    2010-01-01

    This article reviews methods of voice reconstruction. Nonsurgical methods of voice reconstruction include electrolarynx, pneumatic artificial larynx, and esophageal speech. Surgical methods of voice reconstruction include neoglottis, tracheoesophageal puncture, and prosthesis. Tracheoesophageal puncture can be performed in patients with pedicled flaps such as colon interposition, jejunum, or gastric pull-up or in free flaps such as perforator flaps, jejunum, and colon flaps. Other flaps for voice reconstruction include the ileocolon flap and jejunum. Laryngeal transplantation is also reviewed. PMID:22550443

  7. New Dry Fractionation Methods

    NASA Technical Reports Server (NTRS)

    McKay, David S.; Cooper, Bonnie L.

    2010-01-01

    This slide presentation describes new fractionation methods that are used to create dust that is respirable for testing the effects of inhalation of lunar dust in preparation for future manned lunar exploration. Because lunar dust is a very limited commodity, a method that does not result in loss of the material had to be developed. The dust separation system that is described incorporates some traditional methods, while preventing the dust from being contaminated or changed in reactivity properties while also limiting losses.

  8. The Schwinger Variational Method

    NASA Technical Reports Server (NTRS)

    Huo, Winifred M.

    1995-01-01

    Variational methods have proven invaluable in theoretical physics and chemistry, both for bound state problems and for the study of collision phenomena. For collisional problems they can be grouped into two types: those based on the Schroedinger equation and those based on the Lippmann-Schwinger equation. The application of the Schwinger variational (SV) method to e-molecule collisions and photoionization has been reviewed previously. The present chapter discusses the implementation of the SV method as applied to e-molecule collisions.

  9. Spectral methods for CFD

    NASA Technical Reports Server (NTRS)

    Zang, Thomas A.; Streett, Craig L.; Hussaini, M. Yousuff

    1989-01-01

    One of the objectives of these notes is to provide a basic introduction to spectral methods with a particular emphasis on applications to computational fluid dynamics. Another objective is to summarize some of the most important developments in spectral methods in the last two years. The fundamentals of spectral methods for simple problems will be covered in depth, and the essential elements of several fluid dynamical applications will be sketched.

  10. Multigrid contact detection method

    NASA Astrophysics Data System (ADS)

    He, Kejing; Dong, Shoubin; Zhou, Zhaoyao

    2007-03-01

    Contact detection is a general problem of many physical simulations. This work presents a O(N) multigrid method for general contact detection problems (MGCD). The multigrid idea is integrated with contact detection problems. Both the time complexity and memory consumption of the MGCD are O(N) . Unlike other methods, whose efficiencies are influenced strongly by the object size distribution, the performance of MGCD is insensitive to the object size distribution. We compare the MGCD with the no binary search (NBS) method and the multilevel boxing method in three dimensions for both time complexity and memory consumption. For objects with similar size, the MGCD is as good as the NBS method, both of which outperform the multilevel boxing method regarding memory consumption. For objects with diverse size, the MGCD outperform both the NBS method and the multilevel boxing method. We use the MGCD to solve the contact detection problem for a granular simulation system based on the discrete element method. From this granular simulation, we get the density property of monosize packing and binary packing with size ratio equal to 10. The packing density for monosize particles is 0.636. For binary packing with size ratio equal to 10, when the number of small particles is 300 times as the number of big particles, the maximal packing density 0.824 is achieved.

  11. An Extended Lagrangian Method

    NASA Technical Reports Server (NTRS)

    Liou, Meng-Sing

    1995-01-01

    A unique formulation of describing fluid motion is presented. The method, referred to as 'extended Lagrangian method,' is interesting from both theoretical and numerical points of view. The formulation offers accuracy in numerical solution by avoiding numerical diffusion resulting from mixing of fluxes in the Eulerian description. The present method and the Arbitrary Lagrangian-Eulerian (ALE) method have a similarity in spirit-eliminating the cross-streamline numerical diffusion. For this purpose, we suggest a simple grid constraint condition and utilize an accurate discretization procedure. This grid constraint is only applied to the transverse cell face parallel to the local stream velocity, and hence our method for the steady state problems naturally reduces to the streamline-curvature method, without explicitly solving the steady stream-coordinate equations formulated a priori. Unlike the Lagrangian method proposed by Loh and Hui which is valid only for steady supersonic flows, the present method is general and capable of treating subsonic flows and supersonic flows as well as unsteady flows, simply by invoking in the same code an appropriate grid constraint suggested in this paper. The approach is found to be robust and stable. It automatically adapts to flow features without resorting to clustering, thereby maintaining rather uniform grid spacing throughout and large time step. Moreover, the method is shown to resolve multi-dimensional discontinuities with a high level of accuracy, similar to that found in one-dimensional problems.

  12. Methods of inventory control.

    PubMed

    Lindley, C; Mackowiak, J

    1985-01-01

    Various methods for controlling inventory are described, and the advantages and disadvantages of each are discussed. The open-to-buy (OTB) budget method limits purchases to a specific amount of funds available for purchasing pharmaceuticals during a specified period. The emphasis of the OTB method is financial control of the pharmacy inventory. Although it is useful in monitoring and adjusting the dollar value of the inventory, it should be combined with other methods for a total inventory control system. The primary emphasis of the short-list method is to provide accurate and timely inventory information to the person responsible for order placement. The short list identifies the items that are in short supply. It is the most common feedback and control mechanism in use, but it is best suited for settings where duplicate or reserve stock is maintained and monitored by more rigorous methods. The main objective of the minimum and maximum method is to determine when and how much to order of each item. It also provides limited dollar control. The major disadvantage of this method is the time it requires to establish the minimum and maximum levels and to update them regularly to reflect changes in demand. The stock record card method is used to record information on the movement of goods in and out of the storage area. Stock cards can also be used to monitor inventory levels and facilitate order initiation. It is probably the optimum method to be used alone. The most effective system of inventory control is one employing a combination of these methods tailored to meet the institution's needs and available resources. PMID:3970028

  13. Sampling system and method

    DOEpatents

    Decker, David L; Lyles, Brad F; Purcell, Richard G; Hershey, Ronald Lee

    2014-05-20

    An apparatus and method for supporting a tubing bundle during installation or removal. The apparatus includes a clamp for securing the tubing bundle to an external wireline. The method includes deploying the tubing bundle and wireline together, The tubing bundle is periodically secured to the wireline using a clamp.

  14. Improved nonlinear prediction method

    NASA Astrophysics Data System (ADS)

    Adenan, Nur Hamiza; Md Noorani, Mohd Salmi

    2014-06-01

    The analysis and prediction of time series data have been addressed by researchers. Many techniques have been developed to be applied in various areas, such as weather forecasting, financial markets and hydrological phenomena involving data that are contaminated by noise. Therefore, various techniques to improve the method have been introduced to analyze and predict time series data. In respect of the importance of analysis and the accuracy of the prediction result, a study was undertaken to test the effectiveness of the improved nonlinear prediction method for data that contain noise. The improved nonlinear prediction method involves the formation of composite serial data based on the successive differences of the time series. Then, the phase space reconstruction was performed on the composite data (one-dimensional) to reconstruct a number of space dimensions. Finally the local linear approximation method was employed to make a prediction based on the phase space. This improved method was tested with data series Logistics that contain 0%, 5%, 10%, 20% and 30% of noise. The results show that by using the improved method, the predictions were found to be in close agreement with the observed ones. The correlation coefficient was close to one when the improved method was applied on data with up to 10% noise. Thus, an improvement to analyze data with noise without involving any noise reduction method was introduced to predict the time series data.

  15. Research Methods in Education

    ERIC Educational Resources Information Center

    Check, Joseph; Schutt, Russell K.

    2011-01-01

    "Research Methods in Education" introduces research methods as an integrated set of techniques for investigating questions about the educational world. This lively, innovative text helps students connect technique and substance, appreciate the value of both qualitative and quantitative methodologies, and make ethical research decisions.…

  16. WWW: The Scientific Method

    ERIC Educational Resources Information Center

    Blystone, Robert V.; Blodgett, Kevin

    2006-01-01

    The scientific method is the principal methodology by which biological knowledge is gained and disseminated. As fundamental as the scientific method may be, its historical development is poorly understood, its definition is variable, and its deployment is uneven. Scientific progress may occur without the strictures imposed by the formal…

  17. Water treatment method

    DOEpatents

    Martin, F.S.; Silver, G.L.

    1991-04-30

    A method is described for reducing the concentration of any undesirable metals dissolved in contaminated water, such as waste water. The method involves uniformly reacting the contaminated water with an excess amount of solid particulate calcium sulfite to insolubilize the undesirable metal ions, followed by removal thereof and of the unreacted calcium sulfite.

  18. The Oxygen Flask Method

    ERIC Educational Resources Information Center

    Boulton, L. H.

    1973-01-01

    Discusses application of Schoniger's method of quantitative organic elemental analysis in teaching of qualitative analysis of the halogens, nitrogen, sulphur, and phosphorus. Indicates that the oxygen flask method is safe and suitable for both high school and college courses because of simple apparatus requirements. (CC)

  19. Research Methods in Education

    ERIC Educational Resources Information Center

    Check, Joseph; Schutt, Russell K.

    2011-01-01

    "Research Methods in Education" introduces research methods as an integrated set of techniques for investigating questions about the educational world. This lively, innovative text helps students connect technique and substance, appreciate the value of both qualitative and quantitative methodologies, and make ethical research decisions. It weaves…

  20. Methods for data classification

    DOEpatents

    Garrity, George; Lilburn, Timothy G.

    2011-10-11

    The present invention provides methods for classifying data and uncovering and correcting annotation errors. In particular, the present invention provides a self-organizing, self-correcting algorithm for use in classifying data. Additionally, the present invention provides a method for classifying biological taxa.

  1. Methods of Motivational Teaching

    ERIC Educational Resources Information Center

    Malouff, John M.; Rooke, Sally E.; Schutte, Nicola S.; Foster, Roxanne M.; Bhullar, Navjot

    2008-01-01

    As teachers, we want to motivate our students to learn during a unit and to continue learning about the topic after the unit ends. This article describes about a hundred methods we use to help motivate students to learn. The methods form 12 categories: (1) making content relevant to student values and goals; (2) helping students achieve their…

  2. Data center cooling method

    DOEpatents

    Chainer, Timothy J.; Dang, Hien P.; Parida, Pritish R.; Schultz, Mark D.; Sharma, Arun

    2015-08-11

    A method aspect for removing heat from a data center may use liquid coolant cooled without vapor compression refrigeration on a liquid cooled information technology equipment rack. The method may also include regulating liquid coolant flow to the data center through a range of liquid coolant flow values with a controller-apparatus based upon information technology equipment temperature threshold of the data center.

  3. The Method of Archimedes.

    ERIC Educational Resources Information Center

    Del Grande, John

    1993-01-01

    Describes the method that Archimedes utilized to calculate the volumes of spheres and other solids. The method found the volume of a sphere by comparing the mass of parallel slices of a sphere and a cone with that of a cylinder of known mass. (MDH)

  4. New Adsorption Methods.

    ERIC Educational Resources Information Center

    Wankat, Phillip C.

    1984-01-01

    Discusses a simple method for following the movement of a solute in an adsorption or ion exchange system. This movement is used to study a variety of operational methods, including continuous flow and pulsed flow counter-current operations and simulated counter-current systems. Effect of changing thermodynamic variables is also considered. (JM)

  5. Proven Weight Loss Methods

    MedlinePlus

    Fact Sheet Proven Weight Loss Methods What can weight loss do for you? Losing weight can improve your health in a number of ways. It can lower ... at www.hormone.org/Spanish . Proven Weight Loss Methods Fact Sheet www.hormone.org

  6. DISCOURSE ON METHODS.

    ERIC Educational Resources Information Center

    BOUCHER, JOHN G.

    THE AUTHOR STATES THAT BEFORE PRESENT FOREIGN LANGUAGE TEACHING METHODS CAN BE DISCUSSED INTELLIGENTLY, THE RESEARCH IN PSYCHOLOGY AND LINGUISTICS WHICH HAS INFLUENCED THE DEVELOPMENT OF THESE METHODS MUST BE CONSIDERED. MANY FOREIGN LANGUAGE TEACHERS WERE BEGINNING TO FEEL COMFORTABLE WITH THE AUDIOLINGUAL APPROACH WHEN NOAM CHOMSKY, IN HIS 1966…

  7. Method of forming nanodielectrics

    DOEpatents

    Tuncer, Enis [Knoxville, TN; Polyzos, Georgios [Oak Ridge, TN

    2014-01-07

    A method of making a nanoparticle filled dielectric material. The method includes mixing nanoparticle precursors with a polymer material and reacting the nanoparticle mixed with the polymer material to form nanoparticles dispersed within the polymer material to form a dielectric composite.

  8. Water treatment method

    DOEpatents

    Martin, Frank S.; Silver, Gary L.

    1991-04-30

    A method for reducing the concentration of any undesirable metals dissolved in contaminated water, such as waste water. The method involves uniformly reacting the contaminated water with an excess amount of solid particulate calcium sulfite to insolubilize the undesirable metal ions, followed by removal thereof and of the unreacted calcium sulfite.

  9. Geopositional Statistical Methods

    NASA Technical Reports Server (NTRS)

    Ross, Kenton

    2006-01-01

    RMSE based methods distort circular error estimates (up to 50% overestimation). The empirical approach is the only statistically unbiased estimator offered. Ager modification to Shultz approach is nearly unbiased, but cumbersome. All methods hover around 20% uncertainty (@ 95% confidence) for low geopositional bias error estimates. This requires careful consideration in assessment of higher accuracy products.

  10. REVA DATA INTEGRATION METHODS

    EPA Science Inventory

    The core of the research effort in the Regional Vulnerability Assessment Program (ReVA) is a set of data integration methods ranging from simple overlays to complex multivariate statistics. These methods are described in the EPA publication titled, "Regional Vulnerability Assess...

  11. Methods of beam cooling

    SciTech Connect

    Sessler, A.M.

    1996-02-01

    Diverse methods which are available for particle beam cooling are reviewed. They consist of some highly developed techniques such as radiation damping, electron cooling, stochastic cooling and the more recently developed, laser cooling. Methods which have been theoretically developed, but not yet achieved experimentally, are also reviewed. They consist of ionization cooling, laser cooling in three dimensions and stimulated radiation cooling.

  12. Validating Analytical Methods

    ERIC Educational Resources Information Center

    Ember, Lois R.

    1977-01-01

    The procedures utilized by the Association of Official Analytical Chemists (AOAC) to develop, evaluate, and validate analytical methods for the analysis of chemical pollutants are detailed. Methods validated by AOAC are used by the EPA and FDA in their enforcement programs and are granted preferential treatment by the courts. (BT)

  13. Reading Methods Comparison

    ERIC Educational Resources Information Center

    Montgomery, Joel R.

    2008-01-01

    This working paper explores contemporary research related to methods for teaching reading in Spanish and English in bilingual, foreign language, and English as a second language (ESL) classrooms. Changes stemming from innovations in research and learning are identified and a table is provided to compare methods of teaching reading in Spanish and…

  14. Maps and navigation methods

    NASA Technical Reports Server (NTRS)

    Duval, A

    1922-01-01

    Different maps and scales are discussed with particular emphasis on their use in aviation. The author makes the observation that current navigation methods are slow and dangerous and should be replaced by scientific methods of navigation based on loxodromy and the use of the compass.

  15. Ab initio calculations and analysis of chemical bonding in SrTiO3 and SrZrO3 cubic crystals

    NASA Astrophysics Data System (ADS)

    Evarestov, R. A.; Tupitsyn, I. I.; Bandura, A. V.; Alexandrov, V. E.

    The possibility of the different first-principles methods to describe the chemical bonding in SrTiO3 and SrZrO3 cubic crystals is investigated. The local properties of the electronic structure (atomic charges, bond orders, atomic delocalization indexes, and polarization fractions) were calculated with different methods: traditional Mulliken population analysis in LCAO calculations, two projection techniques in plane-wave (PW) calculations, population analysis based on Wannier-type atomic orbitals, and chemical bonding analysis based on the localized Wannier functions for occupied (valence band) LCAO states. All the techniques considered except the traditional Mulliken analysis demonstrate that the ionicity of chemical bonding in SrZrO3 is larger than in SrTiO3, in agreement with the Zr and Ti electronegativities relation and the relative bandgaps observed.

  16. High energy Compton spectroscopy and electronic structure of Laves phase ZrFe2

    NASA Astrophysics Data System (ADS)

    Bhatt, Samir; Kumar, Kishor; Arora, Gunjan; Bapna, Komal; Ahuja, B. L.

    2016-08-01

    We present the first-ever experimental Compton profile of Laves phase ZrFe2 using indigenous 20 Ci 137Cs Compton spectrometer. To annotate the experimental electron momentum density, we have calculated the theoretical Compton profiles using density functional theory (DFT) and hybridization of Hartree-Fock and DFT within linear combination of atomic orbitals (LCAO) method. The spin-polarized energy bands and density of states are computed using LCAO and full potential-linearized augmented plane wave methods. The revised Perdew-Burke-Ernzerhof functional (for solids) based theoretical profile gives a marginally better agreement with the experimental profile as compared to other approximations considered in the present work. The Fermi surface topology of ZrFe2 is explained in terms of majority- and minority-spin energy bands.

  17. Probabilistic boundary element method

    NASA Technical Reports Server (NTRS)

    Cruse, T. A.; Raveendra, S. T.

    1989-01-01

    The purpose of the Probabilistic Structural Analysis Method (PSAM) project is to develop structural analysis capabilities for the design analysis of advanced space propulsion system hardware. The boundary element method (BEM) is used as the basis of the Probabilistic Advanced Analysis Methods (PADAM) which is discussed. The probabilistic BEM code (PBEM) is used to obtain the structural response and sensitivity results to a set of random variables. As such, PBEM performs analogous to other structural analysis codes such as finite elements in the PSAM system. For linear problems, unlike the finite element method (FEM), the BEM governing equations are written at the boundary of the body only, thus, the method eliminates the need to model the volume of the body. However, for general body force problems, a direct condensation of the governing equations to the boundary of the body is not possible and therefore volume modeling is generally required.

  18. The Schwinger Variational Method

    NASA Technical Reports Server (NTRS)

    Huo, Winifred M.

    1995-01-01

    Variational methods have proven invaluable in theoretical physics and chemistry, both for bound state problems and for the study of collision phenomena. The application of the Schwinger variational (SV) method to e-molecule collisions and molecular photoionization has been reviewed previously. The present chapter discusses the implementation of the SV method as applied to e-molecule collisions. Since this is not a review of cross section data, cross sections are presented only to server as illustrative examples. In the SV method, the correct boundary condition is automatically incorporated through the use of Green's function. Thus SV calculations can employ basis functions with arbitrary boundary conditions. The iterative Schwinger method has been used extensively to study molecular photoionization. For e-molecule collisions, it is used at the static exchange level to study elastic scattering and coupled with the distorted wave approximation to study electronically inelastic scattering.

  19. John Herschel's Graphical Method

    NASA Astrophysics Data System (ADS)

    Hankins, Thomas L.

    2011-01-01

    In 1833 John Herschel published an account of his graphical method for determining the orbits of double stars. He had hoped to be the first to determine such orbits, but Felix Savary in France and Johann Franz Encke in Germany beat him to the punch using analytical methods. Herschel was convinced, however, that his graphical method was much superior to analytical methods, because it used the judgment of the hand and eye to correct the inevitable errors of observation. Line graphs of the kind used by Herschel became common only in the 1830s, so Herschel was introducing a new method. He also found computation fatiguing and devised a "wheeled machine" to help him out. Encke was skeptical of Herschel's methods. He said that he lived for calculation and that the English would be better astronomers if they calculated more. It is difficult to believe that the entire Scientific Revolution of the 17th century took place without graphs and that only a few examples appeared in the 18th century. Herschel promoted the use of graphs, not only in astronomy, but also in the study of meteorology and terrestrial magnetism. Because he was the most prominent scientist in England, Herschel's advocacy greatly advanced graphical methods.

  20. Catalytic reforming methods

    DOEpatents

    Tadd, Andrew R; Schwank, Johannes

    2013-05-14

    A catalytic reforming method is disclosed herein. The method includes sequentially supplying a plurality of feedstocks of variable compositions to a reformer. The method further includes adding a respective predetermined co-reactant to each of the plurality of feedstocks to obtain a substantially constant output from the reformer for the plurality of feedstocks. The respective predetermined co-reactant is based on a C/H/O atomic composition for a respective one of the plurality of feedstocks and a predetermined C/H/O atomic composition for the substantially constant output.

  1. Modern Methods of Testing

    NASA Technical Reports Server (NTRS)

    Seeber, F

    1939-01-01

    After a brief survey of the commonly used single-value test methods, the importance of the determination of the incipient knock for the octane number is discussed and improvements suggested for the knock testing in the CFR engine. The DVL supercharge test method with its superiority of direct determination of fuel knock in each single cylinder of an airplane engine without involving structural changes, is described and the advantages of a multiple-value method enumerated. A diagrammatic presentation of the knock characteristics is presented.

  2. Method of sound synthesis

    DOEpatents

    Miner, Nadine E.; Caudell, Thomas P.

    2004-06-08

    A sound synthesis method for modeling and synthesizing dynamic, parameterized sounds. The sound synthesis method yields perceptually convincing sounds and provides flexibility through model parameterization. By manipulating model parameters, a variety of related, but perceptually different sounds can be generated. The result is subtle changes in sounds, in addition to synthesis of a variety of sounds, all from a small set of models. The sound models can change dynamically according to changes in the simulation environment. The method is applicable to both stochastic (impulse-based) and non-stochastic (pitched) sounds.

  3. Cleaning method and apparatus

    DOEpatents

    Jackson, D.D.; Hollen, R.M.

    1981-02-27

    A method of very thoroughly and quikcly cleaning a guaze electrode used in chemical analyses is given, as well as an automobile cleaning apparatus which makes use of the method. The method generates very little waste solution, and this is very important in analyzing radioactive materials, especially in aqueous solutions. The cleaning apparatus can be used in a larger, fully automated controlled potential coulometric apparatus. About 99.98% of a 5 mg plutonium sample was removed in less than 3 minutes, using only about 60 ml of rinse solution and two main rinse steps.

  4. Introduction to multigrid methods

    NASA Technical Reports Server (NTRS)

    Wesseling, P.

    1995-01-01

    These notes were written for an introductory course on the application of multigrid methods to elliptic and hyperbolic partial differential equations for engineers, physicists and applied mathematicians. The use of more advanced mathematical tools, such as functional analysis, is avoided. The course is intended to be accessible to a wide audience of users of computational methods. We restrict ourselves to finite volume and finite difference discretization. The basic principles are given. Smoothing methods and Fourier smoothing analysis are reviewed. The fundamental multigrid algorithm is studied. The smoothing and coarse grid approximation properties are discussed. Multigrid schedules and structured programming of multigrid algorithms are treated. Robustness and efficiency are considered.

  5. Method for inducing hypothermia

    DOEpatents

    Becker, Lance B.; Hoek, Terry Vanden; Kasza, Kenneth E.

    2003-04-15

    Systems for phase-change particulate slurry cooling equipment and methods to induce hypothermia in a patient through internal and external cooling are provided. Subcutaneous, intravascular, intraperitoneal, gastrointestinal, and lung methods of cooling are carried out using saline ice slurries or other phase-change slurries compatible with human tissue. Perfluorocarbon slurries or other slurry types compatible with human tissue are used for pulmonary cooling. And traditional external cooling methods are improved by utilizing phase-change slurry materials in cooling caps and torso blankets.

  6. Method for inducing hypothermia

    DOEpatents

    Becker, Lance B.; Hoek, Terry Vanden; Kasza, Kenneth E.

    2005-11-08

    Systems for phase-change particulate slurry cooling equipment and methods to induce hypothermia in a patient through internal and external cooling are provided. Subcutaneous, intravascular, intraperitoneal, gastrointestinal, and lung methods of cooling are carried out using saline ice slurries or other phase-change slurries compatible with human tissue. Perfluorocarbon slurries or other slurry types compatible with human tissue are used for pulmonary cooling. And traditional external cooling methods are improved by utilizing phase-change slurry materials in cooling caps and torso blankets.

  7. Method for inducing hypothermia

    DOEpatents

    Becker, Lance B.; Hoek, Terry Vanden; Kasza, Kenneth E.

    2008-09-09

    Systems for phase-change particulate slurry cooling equipment and methods to induce hypothermia in a patient through internal and external cooling are provided. Subcutaneous, intravascular, intraperitoneal, gastrointestinal, and lung methods of cooling are carried out using saline ice slurries or other phase-change slurries compatible with human tissue. Perfluorocarbon slurries or other slurry types compatible with human tissue are used for pulmonary cooling. And traditional external cooling methods are improved by utilizing phase-change slurry materials in cooling caps and torso blankets.

  8. Methods of flash sintering

    DOEpatents

    Raj, Rishi; Cologna, Marco; Francis, John S.

    2016-05-10

    This disclosure provides methods of flash sintering and compositions created by these methods. Methods for sintering multilayered bodies are provided in which a sintered body is produced in less than one minute. In one aspect, each layer is of a different composition, and may be constituted wholly from a ceramic or from a combination of ceramic and metallic particles. When the body includes a layer of an anode composition, a layer of an electrolyte composition and a layer of a cathode composition, the sintered body can be used to produce a solid oxide fuel cell.

  9. Method for fusing bone

    DOEpatents

    Mourant, Judith R.; Anderson, Gerhard D.; Bigio, Irving J.; Johnson, Tamara M.

    1996-01-01

    Method for fusing bone. The present invention is a method for joining hard tissue which includes chemically removing the mineral matrix from a thin layer of the surfaces to be joined, placing the two bones together, and heating the joint using electromagnetic radiation. The goal of the method is not to produce a full-strength weld of, for example, a cortical bone of the tibia, but rather to produce a weld of sufficient strength to hold the bone halves in registration while either external fixative devices are applied to stabilize the bone segments, or normal healing processes restore full strength to the tibia.

  10. Generalized subspace correction methods

    SciTech Connect

    Kolm, P.; Arbenz, P.; Gander, W.

    1996-12-31

    A fundamental problem in scientific computing is the solution of large sparse systems of linear equations. Often these systems arise from the discretization of differential equations by finite difference, finite volume or finite element methods. Iterative methods exploiting these sparse structures have proven to be very effective on conventional computers for a wide area of applications. Due to the rapid development and increasing demand for the large computing powers of parallel computers, it has become important to design iterative methods specialized for these new architectures.

  11. Band structure analysis of (1 × 2)-H/Pd(110)-pr

    NASA Astrophysics Data System (ADS)

    Shuttleworth, I. G.

    2013-09-01

    A novel method of band structure analysis based on the atomic orbital (AO) coefficients in LCAO-DFT has been applied to the (1 × 2)-H/Pd(110)-pr system. The analysis has revealed symmetry-dependent Pd 4d band splitting due to H ligand effects; ensemble effects due to the (1 × 2) Pd reconstruction are shown to be relatively minor.

  12. Properties and construction of azo-dye reagents for inorganic photometric analysis.

    PubMed

    Pilipenko, A T; Savransky, L I

    1978-08-01

    An approach to constructing new organic reagents (based on azo dyes) for photometric analysis is described. Its essence is the detailed consideration of the electronic structure of the chromophore nuclei of the dyes in the ground and excited states. Knowing the nature of the electron transition, it is possible to construct the organic reagents with optimal properties. The electronic structure of the azo dyes has been analysed in a pi-approximation by an MO LCAO SCF method. PMID:18962298

  13. [The oxenoid model of the mechanism of activating molecular oxygen by cytochrome p450: the role of substrate structure].

    PubMed

    Kuznetsov, A V

    1990-01-01

    The arene oxides formation energy for about 30 benzene derivatives were calculated in frames of MO LCAO method. The benzene derivatives are typical substrates of cytochrome P-450 catalyzed aromatic oxidation. The relationship between the formation energy of tetrahedral type arene oxides and the relative reactivity of substrates toward microsomal hydroxylation was found. The formation energy of arene oxides correlates also with toxicity of benzene derivatives. Some limitations of the oxenoid model are discussed. PMID:2290428

  14. Structure electronic and ionic conductivity study versus Ca content in Ca{sub 10-x}Sr{sub x}(PO{sub 4}){sub 6}F{sub 2} apatites

    SciTech Connect

    Sghir, B.; Hlil, E.K.; Laghzizil, A.; Boujrhal, F.Z.; Cherkaoui El Moursli, R.; Fruchart, D.

    2009-07-01

    Substitution effect on the crystallographic structure in Ca{sub 10-x}Sr{sub x}(PO{sub 4}){sub 6}F{sub 2} solid solution are studied by X-ray diffraction patterns and Rietveld refinements. Full potential electronic structure calculations based on LCAO (linear combination atomic orbital) are also performed using the obtained crystallographic parameters. DOS modification and the charge transfer are estimated versus the calcium content. According to the complex impedance method, ionic conductivity changes are explained.

  15. Methods of Studying Persons.

    ERIC Educational Resources Information Center

    Heinemann, Allen W.; Shontz, Franklin C.

    1985-01-01

    Describes a method that permits answering research questions of general importance by examining individuals in a comprehensive, whole-person manner. Discusses their use in two studies of persons with spinal cord injuries. (LLL)

  16. PARTICLE SEPARATION METHOD

    DOEpatents

    Anderson, N.G.

    1963-01-29

    An improved method of sedimentation is described. A series of spaced surfaces of powdered material positioned normal to the centrifugal field concentrates the larger, slower moving molecules of a liquid and hastens sedimentation. (AEC)

  17. Iii. Sleep assessment methods.

    PubMed

    Sadeh, Avi

    2015-03-01

    Sleep is a complex phenomenon that could be understood and assessed at many levels. Sleep could be described at the behavioral level (relative lack of movements and awareness and responsiveness) and at the brain level (based on EEG activity). Sleep could be characterized by its duration, by its distribution during the 24-hr day period, and by its quality (e.g., consolidated versus fragmented). Different methods have been developed to assess various aspects of sleep. This chapter covers the most established and common methods used to assess sleep in infants and children. These methods include polysomnography, videosomnography, actigraphy, direct observations, sleep diaries, and questionnaires. The advantages and disadvantages of each method are highlighted. PMID:25704734

  18. The Myopia of Methods

    ERIC Educational Resources Information Center

    Zahorik, John A.

    1973-01-01

    The purpose of this paper is to examine a problem that exists in relation to teaching methods and which has quite possibly served to limit the value of many promising methodologies that have been developed. (Author)

  19. Concrete compositions and methods

    SciTech Connect

    Chen, Irvin; Lee, Patricia Tung; Patterson, Joshua

    2015-06-23

    Provided herein are compositions, methods, and systems for cementitious compositions containing calcium carbonate compositions and aggregate. The compositions find use in a variety of applications, including use in a variety of building materials and building applications.

  20. Method for synthesizing boracities

    DOEpatents

    Wolf, Gary A [Kennewick, WA

    1982-01-01

    A method for producing boracites is disclosed in which a solution of divalent metal acetate, boric acid, and halogen acid is evaporated to dryness and the resulting solid is heated in an inert atmosphere under pressure.

  1. Project Delivery Methods.

    ERIC Educational Resources Information Center

    Dolan, Thomas G.

    2003-01-01

    Describes project delivery methods that are replacing the traditional Design/Bid/Build linear approach to the management, design, and construction of new facilities. These variations can enhance construction management and teamwork. (SLD)

  2. Ignitability test method

    NASA Technical Reports Server (NTRS)

    Bement, Laurence J.; Schimmel, Morry L.

    1989-01-01

    To overcome serious weaknesses in determining the performance of initiating devices, a novel 'ignitability test method', representing actual design interfaces and ignition materials, has been developed. Ignition device output consists of heat, light, gas an burning particles. Past research methods have evaluated these parameters individually. This paper describes the development and demonstration of an ignitability test method combining all these parameters, and the quantitative assessment of the ignition performance of two widely used percussion primers, the M42C1-PA101 and the M42C2-793. The ignition materials used for this evaluation were several powder, granule and pellet sizes of black powder and boron-potassium nitrate. This test method should be useful for performance evaluation of all initiator types, quality assurance, evaluation of ignition interfaces, and service life studies of initiators and ignition materials.

  3. METHOD OF BRAZING

    DOEpatents

    Patriarca, P.; Slaughter, G.M.

    1962-11-27

    A method of joining metal surfaces is given. Surfaces having nickel or iron as the base metal are joined together with a brazing composition consisting of 80% nickel, 10% phosphorus, and 10% chromium. (AEC)

  4. Ensemble Data Mining Methods

    NASA Technical Reports Server (NTRS)

    Oza, Nikunj C.

    2004-01-01

    Ensemble Data Mining Methods, also known as Committee Methods or Model Combiners, are machine learning methods that leverage the power of multiple models to achieve better prediction accuracy than any of the individual models could on their own. The basic goal when designing an ensemble is the same as when establishing a committee of people: each member of the committee should be as competent as possible, but the members should be complementary to one another. If the members are not complementary, Le., if they always agree, then the committee is unnecessary---any one member is sufficient. If the members are complementary, then when one or a few members make an error, the probability is high that the remaining members can correct this error. Research in ensemble methods has largely revolved around designing ensembles consisting of competent yet complementary models.

  5. Method for making organooxysilanes

    DOEpatents

    Schattenmann, Florian Johannes

    2003-12-23

    A method for the preparation of organooxysilanes containing at least one silicon-carbon bond is provided which comprises reacting at least one tetraorganooxysilane with at least one transition metal organo compound.

  6. Adaptive Algebraic Multigrid Methods

    SciTech Connect

    Brezina, M; Falgout, R; MacLachlan, S; Manteuffel, T; McCormick, S; Ruge, J

    2004-04-09

    Our ability to simulate physical processes numerically is constrained by our ability to solve the resulting linear systems, prompting substantial research into the development of multiscale iterative methods capable of solving these linear systems with an optimal amount of effort. Overcoming the limitations of geometric multigrid methods to simple geometries and differential equations, algebraic multigrid methods construct the multigrid hierarchy based only on the given matrix. While this allows for efficient black-box solution of the linear systems associated with discretizations of many elliptic differential equations, it also results in a lack of robustness due to assumptions made on the near-null spaces of these matrices. This paper introduces an extension to algebraic multigrid methods that removes the need to make such assumptions by utilizing an adaptive process. The principles which guide the adaptivity are highlighted, as well as their application to algebraic multigrid solution of certain symmetric positive-definite linear systems.

  7. Mathematics Case Methods Project.

    ERIC Educational Resources Information Center

    Barnett, Carne S.

    1998-01-01

    Presents an overview and analysis of the Mathematics Case Methods Project, which uses cases in order to examine and reflect upon teaching. Focuses on a special kind of teacher knowledge, coined pedagogical-content knowledge. (ASK)

  8. Method for making organyltriorganooxysilanes

    DOEpatents

    Schattenmann, Florian Johannes

    2002-01-01

    A method for the preparation of organyltriorganooxysilanes containing at least one silicon-carbon bond is provided comprising reacting at least one tetraorganooxysilane with an activated carbon and at least one base.

  9. Plating methods, a survey

    NASA Technical Reports Server (NTRS)

    Berkowitz, J. B.; Emerson, N. H.

    1972-01-01

    Results are presented of a comprehensive search of the literature available, much of which has been generated by the research centers of NASA and its contractors, on plating and coating methods and techniques. Methods covered included: (1) electroplating from aqueous solutions; (2) electroplating from nonaqueous solutions; (3) electroplating from fused-salt baths; (4) electroforming; (5) electroless plating, immersion plating, and mirroring; (6) electroplating from gaseous plasmas; and (7) anodized films and conversion coatings.

  10. Method of saccharifying cellulose

    DOEpatents

    Johnson, Eric A.; Demain, Arnold L.; Madia, Ashwin

    1985-09-10

    A method of saccharifying cellulose by incubation with the cellulase of Clostridium thermocellum in a broth containing an efficacious amount of a reducing agent. Other incubation parameters which may be advantageously controlled to stimulate saccharification include the concentration of alkaline earth salts, pH, temperature, and duration. By the method of the invention, even native crystalline cellulose such as that found in cotton may be completely saccharified.

  11. Method of treating depression

    DOEpatents

    Henn, Fritz

    2013-04-09

    Methods for treatment of depression-related mood disorders in mammals, particularly humans are disclosed. The methods of the invention include administration of compounds capable of enhancing glutamate transporter activity in the brain of mammals suffering from depression. ATP-sensitive K.sup.+ channel openers and .beta.-lactam antibiotics are used to enhance glutamate transport and to treat depression-related mood disorders and depressive symptoms.

  12. Method selection made easy.

    PubMed

    Legrain, G; Delvoye, P; Salami, L

    1992-05-01

    The Togolese National Family Welfare Programme introduced a visit card system for method selection in 1989 developed several years earlier in Burundi. Thereby the health worker is aided in choosing the best contraceptive method for each client on the basis of personal data, medical history, and a general and gynecological examination. the card is also used makes the selection by taking into account contraindications and considering them in conjunction with the client's individual profile. At this stage the innovative aspect of the visit card is that the contraindications are grouped together under 3 headings; those identified by asking questions (e.g., a mother breast feeding for less than 6 weeks),those identified by looking at the client's history (e.g., a recent liver ailment), and those revealed by the general and gynecological examination (e.g., a blood pressure of more than 14/10). The 2nd part of the card concerns the search for the recommended contraceptive method. It includes a list of the methods: rhythm, barrier, IUD, combination pill, low-dose progestogen pill, and injection. A plus sign indicates that the method is recommended, a minus sign indicates that the method is not recommended, and a double minus sign indicates that the method is relatively recommended. A relative contraindication becomes an absolute contraindication if associated with another relative contraindication. After the acceptance of the method, the health worker prescribes it, and advises the client about the follow-up program, any possible side effects, and any warning signs which necessitate another appointment. PMID:12222226

  13. LEAKAGE TESTING METHOD

    DOEpatents

    McAdams, Wm.A.; Foss, M.H.

    1958-08-12

    A method of testing containers for leaks is described, particularly the testing of containers or cans in which the uranium slugs for nuelear reactors are jacketed. This method involves the immersion of the can in water under l50 pounds of pressure, then removing, drying, and coating the can with anhydrous copper sulfate. Amy water absorbed by the can under pressure will exude and discolor the copper sulfate in the area about the leak.

  14. Improved radioanalytical methods

    SciTech Connect

    Erickson, M.D.; Aldstadt, J.H.; Alvarado, J.S.; Crain, J.S.; Orlandini, K.A.; Smith, L.L.

    1995-12-31

    Methods for the chemical characterization of the environment are being developed under a multitask project for the Analytical Services Division (EM-263) within the US Department of Energy (DOE) Office of Environmental Management. This project focuses on improvement of radioanalytical methods with an emphasis on faster and cheaper routine methods. We have developed improved methods, for separation of environmental levels of technetium-99 and strontium-89/90, radium, and actinides from soil and water; and for separation of actinides from soil and water matrix interferences. Among the novel separation techniques being used are element- and class-specific resins and membranes. (The 3M Corporation is commercializing Empore {trademark} membranes under a cooperative research and development agreement [CRADA] initiated under this project). We have also developed methods for simultaneous detection of multiple isotopes using inductively coupled plasma-mass spectrometry (ICP-MS). The ICP-MS method requires less rigorous chemical separations than traditional radiochemical analyses because of its mass-selective mode of detection. Actinides and their progeny have been isolated and concentrated from a variety of natural water matrices by using automated batch separation incorporating selective resins prior to ICP-MS analyses. In addition, improvements in detection limits, sample volume, and time of analysis were obtained by using other sample introduction techniques, such as ultrasonic nebulization and electrothermal vaporization. Integration and automation of the separation methods with the ICP-MS methodology by using flow injection analysis is underway, with an objective of automating methods to achieve more reproducible results, reduce labor costs, cut analysis time, and minimize secondary waste generation through miniaturization of the process.

  15. Method of treating depression

    DOEpatents

    Henn, Fritz

    2012-01-24

    Methods for treatment of depression-related mood disorders in mammals, particularly humans are disclosed. The methods of the invention include administration of compounds capable of enhancing glutamate transporter activity in the brain of mammals suffering from depression. ATP-sensitive K.sup.+ channel openers and .beta.-lactam antibiotics are used to enhance glutamate transport and to treat depression-related mood disorders and depressive symptoms.

  16. Multiscale methods for nanoengineering

    NASA Astrophysics Data System (ADS)

    Jolley, Kenny

    This project is presented in two sections. Two different multiscale models are developed in order to increase the computational speed of two well known atomistic algorithms, Molecular Dynamics (MD) and Kinetic Monte Carlo (KMC). In Section I, the MD method is introduced. Following this, a multiscale method of linking an MD simulation of heat conduction to a finite element (FE) simulation is presented. The method is simple to implement into a conventional MD code and is independent of the atomistic model employed. This bridge between the FE and MD simulations works by ensuring that energy is conserved across the FE/MD boundary. The multiscale simulation allows for the investigation of large systems which are beyond the range of MD. The method is tested extensively in the steady state and transient regimes, and is shown to agree with well with large scale MD and FE simulations. Furthermore, the method removes the artificial boundary effects due to the thermostats and hence allows exact temperatures and temperature gradients to be imposed on to an MD simulation. This allows for better study of temperature gradients on crystal defects etc.. In Section II, the KMC method is introduced. A continuum model for the KMC method is presented and compared to the standard KMC model of surface diffusion. This method replaces the many discrete back and forth atom jumps performed by a standard KMC algorithm with a single flux that can evolve in time. Elastic strain is then incorporated into both algorithms and used to simulate atom deposition upon a substrate by Molecular Beam Epitaxy. Quantum dot formation due to a mismatch in the lattice spacing between a substrate and a deposited film is readily observed in both models. Furthermore, by depositing alternating layers of substrate and deposit, self-organised quantum dot super-lattices are observed in both models..

  17. Method of saccharifying cellulose

    DOEpatents

    Johnson, E.A.; Demain, A.L.; Madia, A.

    1983-05-13

    A method is disclosed of saccharifying cellulose by incubation with the cellulase of Clostridium thermocellum in a broth containing an efficacious amount of thiol reducing agent. Other incubation parameters which may be advantageously controlled to stimulate saccharification include the concentration of alkaline earth salts, pH, temperature, and duration. By the method of the invention, even native crystalline cellulose such as that found in cotton may be completely saccharified.

  18. Methods in Molecular Biophysics

    NASA Astrophysics Data System (ADS)

    Serdyuk, Igor N.; Zaccai, Nathan R.; Zaccai, Joseph

    2001-12-01

    Our knowledge of biological macromolecules and their interactions is based on the application of physical methods, ranging from classical thermodynamics to recently developed techniques for the detection and manipulation of single molecules. These methods, which include mass spectrometry, hydrodynamics, microscopy, diffraction and crystallography, electron microscopy, molecular dynamics simulations, and nuclear magnetic resonance, are complementary; each has its specific advantages and limitations. Organised by method, this textbook provides descriptions and examples of applications for the key physical methods in modern biology. It is an invaluable resource for undergraduate and graduate students of molecular biophysics in science and medical schools, as well as research scientists looking for an introduction to techniques beyond their specialty. As appropriate for this interdisciplinary field, the book includes short asides to explain physics aspects to biologists and biology aspects to physicists. Comprehensive coverage and up-to-date treatment of the latest physical methods in modern biology Each method includes a brief historical introduction, theoretical principles, applications, advantages and limitations, and concludes with a checklist of key ideas Interdisciplinary and accessible to biologists, physicists, and those with medical backgrounds

  19. Anaerobic bag culture method.

    PubMed

    Rosenblatt, J E; Stewart, P R

    1975-06-01

    In a new method of anaerobic culture, a transparent, gas-impermeable bag is used and the anaerobic environment is established with copper sulfate-saturated steel wool. An Alka-Seltzer tablet generates carbon dioxide. The agar plate surface can be inspected through the bag at any time without interrupting the anaerobic atmosphere or disturbing other specimens. Methylene blue indicator strips are completely reduced by 4 h after the bag is set up and have remained reduced for as long as 3 weeks. Growth of 16 different stock culture anaerobes was generally equivalent by the bag and GasPak jar methods. Yield and growth of anaerobic isolates also were equivalent with 7 of 10 clinical specimens; from the other 3 specimens, 13 isolates were recovered, 5 by both the bag and jar methods and the rest by one method or the other. No consistent differences were found between the anaerobic bag and GasPak jar methods in the yield of anaerobes from clinical specimens. Early growth (24 h of incubation) of anaerobes from one specimen was detected with the bag method. PMID:1100671

  20. Anaerobic bag culture method.

    PubMed Central

    Rosenblatt, J E; Stewart, P R

    1975-01-01

    In a new method of anaerobic culture, a transparent, gas-impermeable bag is used and the anaerobic environment is established with copper sulfate-saturated steel wool. An Alka-Seltzer tablet generates carbon dioxide. The agar plate surface can be inspected through the bag at any time without interrupting the anaerobic atmosphere or disturbing other specimens. Methylene blue indicator strips are completely reduced by 4 h after the bag is set up and have remained reduced for as long as 3 weeks. Growth of 16 different stock culture anaerobes was generally equivalent by the bag and GasPak jar methods. Yield and growth of anaerobic isolates also were equivalent with 7 of 10 clinical specimens; from the other 3 specimens, 13 isolates were recovered, 5 by both the bag and jar methods and the rest by one method or the other. No consistent differences were found between the anaerobic bag and GasPak jar methods in the yield of anaerobes from clinical specimens. Early growth (24 h of incubation) of anaerobes from one specimen was detected with the bag method. Images PMID:1100671

  1. The ICARE Method

    NASA Technical Reports Server (NTRS)

    Henke, Luke

    2010-01-01

    The ICARE method is a flexible, widely applicable method for systems engineers to solve problems and resolve issues in a complete and comprehensive manner. The method can be tailored by diverse users for direct application to their function (e.g. system integrators, design engineers, technical discipline leads, analysts, etc.). The clever acronym, ICARE, instills the attitude of accountability, safety, technical rigor and engagement in the problem resolution: Identify, Communicate, Assess, Report, Execute (ICARE). This method was developed through observation of Space Shuttle Propulsion Systems Engineering and Integration (PSE&I) office personnel approach in an attempt to succinctly describe the actions of an effective systems engineer. Additionally it evolved from an effort to make a broadly-defined checklist for a PSE&I worker to perform their responsibilities in an iterative and recursive manner. The National Aeronautics and Space Administration (NASA) Systems Engineering Handbook states, engineering of NASA systems requires a systematic and disciplined set of processes that are applied recursively and iteratively for the design, development, operation, maintenance, and closeout of systems throughout the life cycle of the programs and projects. ICARE is a method that can be applied within the boundaries and requirements of NASA s systems engineering set of processes to provide an elevated sense of duty and responsibility to crew and vehicle safety. The importance of a disciplined set of processes and a safety-conscious mindset increases with the complexity of the system. Moreover, the larger the system and the larger the workforce, the more important it is to encourage the usage of the ICARE method as widely as possible. According to the NASA Systems Engineering Handbook, elements of a system can include people, hardware, software, facilities, policies and documents; all things required to produce system-level results, qualities, properties, characteristics

  2. [The Billings method].

    PubMed

    1981-05-01

    The World Health Organization (WHO) has financed a study of the Billings method of family planning in 3 developing and 2 developed countries to obtain objective data on the effectiveness of the method. Although 40% of the 870 couples had previously used another abstinence method and all were highly motivated to use the technique, the life-table pregnancy rate for the year following training in the method reached 20%. 11 studies of the cervical mucus method have been carried out in India, Tonga, Colombia, and Chile and in the US and Australia, often in new programs which did not employ uniform teaching methods. 2 Indian studies showed pregnancy rates of under 6/100 woman years, while 2 studies in developed countries showed rates under 15 and 2 showed rates over 30/100 woman years. Most of the studies have attributed the high pregnancy rates to the failure of couples to observe abstinence. Pregnancy occurred in the 5 countries partcipating in the WHO studies primarily as a result of the failure of couples to abstain from sexual relations during periods identified as fertile, despite active promotion of natural family planning and assistance from instructors at monthly intervals. Other reasons for the high failure rate were late occurrance of mucus flow relative to the time of ovulation, overly early appearance of mucus, and failure to observe or to interpret correctly the mucus symptom. Mucus patterns and facility of interpretation can be affected by various physiological or psychological factors, such as vaginal or cervical infection, vaginal secretion due to sexual stimulation, medicines, tension, and illness. The common observation of higher pregnancy rates among couples who wish to postpone rather than prevent a birth appears to be particularly important in the case of abstinence methods. PMID:12311398

  3. Electronic properties of Laves phase ZrFe2 using Compton spectroscopy

    NASA Astrophysics Data System (ADS)

    Bhatt, Samir; Kumar, Kishor; Dashora, Alpa; Ahuja, B. L.

    2016-05-01

    First-ever experimental Compton profile of Laves phase ZrFe2, using indigenous 20 Ci 137Cs Compton spectrometer, is presented. To analyze the experimental electron momentum density, we have deduced the theoretical Compton profiles using density functional theory (DFT) and hybridization of DFT and Hartree-Fock scheme within linear combination of atomic orbitals (LCAO) method. The energy bands and density of states are also calculated using LCAO prescription. The theoretical profile based on local density approximation gives a better agreement with the experimental profile than other reported schemes. The present investigations validate the inclusion of correlation potential of Perdew-Zunger in predicting the electronic properties of ZrFe2.

  4. Electronic properties and Compton scattering studies of monoclinic tungsten dioxide

    NASA Astrophysics Data System (ADS)

    Heda, N. L.; Ahuja, Ushma

    2015-01-01

    We present the first ever Compton profile measurement of WO2 using a 20 Ci 137Cs γ-ray source. The experimental data have been used to test different approximations of density functional theory in linear combination of atomic orbitals (LCAO) scheme. It is found that theoretical Compton profile deduced using generalized gradient approximation (GGA) gives a better agreement than local density approximation and second order GGA. The computed energy bands, density of states and Mulliken's populations (MP) data confirm a metal-like behavior of WO2. The electronic properties calculated using LCAO approach are also compared with those obtained using full potential linearized augmented plane wave method. The nature of bonding in WO2 is also compared with isoelectronic WX2 (X=S, Se) compounds in terms of equal-valence-electron-density profiles and MP data, which suggest an increase in ionic character in the order WSe2→WS2→WO2.

  5. Real-time TDDFT simulations of time-resolved core-level spectroscopies in solid state systems

    NASA Astrophysics Data System (ADS)

    Pemmaraju, Sri Chaitanya Das; Prendergast, David; Theory of Nanostructured Materials Facility Team

    The advent of sub-femtosecond time-resolved core-level spectroscopies based on high harmonic generated XUV pulses has enabled the study of electron dyanamics on characteristic femtosecond time-scales. Unambiguous interpretation of these powerful yet complex spectroscopies however requires the development of theoretical algorithms capable of modeling light-matter interaction across a wide energy range spanning both valence and core orbitals. In this context we present a recent implementation of the velocity-gauge formalism of real-time TDDFT within a linear combination of atomic orbital (LCAO) framework, which facilitates efficient numerical treatment of localized semi-core orbitals. Dynamics and spectra obtained from LCAO based simulations are compared to those from a real-space grid implementation. Potential applications are also illustrated by applying the method towards interpreting recent atto-second time-resolved IR-pump XUV-probe spectroscopies investigating sub-cycle excitation dynamics in bulk silicon.

  6. Optical tunability of magnetic polaron stability in single-Mn doped bulk GaAs and GaAs/AlGaAs quantum dots

    NASA Astrophysics Data System (ADS)

    Qu, Fanyao; Moura, Fábio Vieira; Alves, Fabrizio M.; Gargano, Ricardo

    2013-03-01

    Optical control of magnetic property of a magnetic polaron (MP) in Mn-doped bulk GaAs and GaAs/AlGaAs quantum dots (QDs) have been studied. We have developed basis optimization technique for the method of linear combination of atomic orbitals (LCAOs), which significantly improve the accuracy of the conventional LCAO calculation. We have demonstrated that a monochromatic, linearly polarized, intense pulsed laser field induces a collapse of the MP and an ionization of Mn-acceptor in Mn-doped GaAs materials due to a dichotomy of hole wave function. We find this optical tunability of MP stability can be adjusted by confinement introduced in GaAs QDs.

  7. Real space analysis of Compton profile of Heusler alloy Ni2TiAl

    NASA Astrophysics Data System (ADS)

    Sahariya, Jagrati; Mund, H. S.; Ahuja, B. L.

    2012-06-01

    Electron momentum density of Ni2TiAl alloy has been studied using Compton scattering technique. The experiment has been performed using 20 Ci 137Cs (661.65 keV) Compton spectrometer at an intermediate resolution of 0.34 a.u. To interpret the experimental data, we have calculated the Compton profiles using Hartree Fock and density functional theories within the frame work of linear combination of atomic orbitals (LCAO) method. The experimental data have been interpreted in term of autocorrelation function B(z) of the one electron wave function. The experimental B(z) function has been compared with the LCAO based theoretical B(z), to analyze the electronic and structural properties of Ni2TiAl.

  8. Electronic structure of lanthanum sesquioxide: A Compton scattering study

    NASA Astrophysics Data System (ADS)

    Sharma, Sonu; Sahariya, Jagrati; Arora, Gunjan; Ahuja, B. L.

    2014-10-01

    We present the first-ever experimental and theoretical momentum densities of La2O3. The Compton line shape is measured using a 20 Ci 137Cs Compton spectrometer at an intermediate resolution with full width at half maximum of 0.34 a.u. The experimental Compton profile is compared with the theoretical electron momentum densities computed using linear combination of atomic orbitals (LCAO) method with density functional theory (DFT). It is seen that the generalized gradient approximation (GGA) within DFT reconciles better with the experiment than other DFT based approximations, validating the GGA approximation for rare-earth sesquioxides. The energy bands and density of states computed using LCAO calculations show its wide band gap nature which is in tune with the available reflectivity and photo-absorption data. In addition, Mulliken's population and charge density are also computed and discussed.

  9. Panel methods: An introduction

    NASA Technical Reports Server (NTRS)

    Erickson, Larry L.

    1990-01-01

    Panel methods are numerical schemes for solving (the Prandtl-Glauert equation) for linear, inviscid, irrotational flow about aircraft flying at subsonic or supersonic speeds. The tools at the panel-method user's disposal are (1) surface panels of source-doublet-vorticity distributions that can represent nearly arbitrary geometry, and (2) extremely versatile boundary condition capabilities that can frequently be used for creative modeling. Panel-method capabilities and limitations, basic concepts common to all panel-method codes, different choices that were made in the implementation of these concepts into working computer programs, and various modeling techniques involving boundary conditions, jump properties, and trailing wakes are discussed. An approach for extending the method to nonlinear transonic flow is also presented. Three appendices supplement the main test. In appendix 1, additional detail is provided on how the basic concepts are implemented into a specific computer program (PANAIR). In appendix 2, it is shown how to evaluate analytically the fundamental surface integral that arises in the expressions for influence-coefficients, and evaluate its jump property. In appendix 3, a simple example is used to illustrate the so-called finite part of the improper integrals.

  10. Methods for Neutron Spectrometry

    DOE R&D Accomplishments Database

    Brockhouse, Bertram N.

    1961-01-09

    The appropriate theories and the general philosophy of methods of measurement and treatment of data neutron spectrometry are discussed. Methods of analysis of results for liquids using the Van Hove formulation, and for crystals using the Born-von Karman theory, are reviewed. The most useful of the available methods of measurement are considered to be the crystal spectrometer methods and the pulsed monoenergetic beam/time-of-flight method. Pulsed-beam spectrometers have the advantage of higher counting rates than crystal spectrometers, especially in view of the fact that simultaneous measurements in several counters at different angles of scattering are possible in pulsed-beam spectrometers. The crystal spectrometer permits several valuable new types of specialized experiments to be performed, especially energy distribution measurements at constant momentum transfer. The Chalk River triple-axis crystal-spectrometer is discussed, with reference to its use in making the specialized experiments. The Chalk River rotating crystal (pulsed-beam) spectrometer is described, and a comparison of this type instrument with other pulsed-beam spectrometers is made. A partial outline of the theory of operation of rotating-crystal spectrometers is presented. The use of quartz-crystal filters for fast neutron elimination and for order elimination is discussed. (auth)

  11. Optimization Methods in Sherpa

    NASA Astrophysics Data System (ADS)

    Siemiginowska, Aneta; Nguyen, Dan T.; Doe, Stephen M.; Refsdal, Brian L.

    2009-09-01

    Forward fitting is a standard technique used to model X-ray data. A statistic, usually assumed weighted chi^2 or Poisson likelihood (e.g. Cash), is minimized in the fitting process to obtain a set of the best model parameters. Astronomical models often have complex forms with many parameters that can be correlated (e.g. an absorbed power law). Minimization is not trivial in such setting, as the statistical parameter space becomes multimodal and finding the global minimum is hard. Standard minimization algorithms can be found in many libraries of scientific functions, but they are usually focused on specific functions. However, Sherpa designed as general fitting and modeling application requires very robust optimization methods that can be applied to variety of astronomical data (X-ray spectra, images, timing, optical data etc.). We developed several optimization algorithms in Sherpa targeting a wide range of minimization problems. Two local minimization methods were built: Levenberg-Marquardt algorithm was obtained from MINPACK subroutine LMDIF and modified to achieve the required robustness; and Nelder-Mead simplex method has been implemented in-house based on variations of the algorithm described in the literature. A global search Monte-Carlo method has been implemented following a differential evolution algorithm presented by Storn and Price (1997). We will present the methods in Sherpa and discuss their usage cases. We will focus on the application to Chandra data showing both 1D and 2D examples. This work is supported by NASA contract NAS8-03060 (CXC).

  12. Manual of Scaling Methods

    NASA Technical Reports Server (NTRS)

    Bond, Thomas H. (Technical Monitor); Anderson, David N.

    2004-01-01

    This manual reviews the derivation of the similitude relationships believed to be important to ice accretion and examines ice-accretion data to evaluate their importance. Both size scaling and test-condition scaling methods employing the resulting similarity parameters are described, and experimental icing tests performed to evaluate scaling methods are reviewed with results. The material included applies primarily to unprotected, unswept geometries, but some discussion of how to approach other situations is included as well. The studies given here and scaling methods considered are applicable only to Appendix-C icing conditions. Nearly all of the experimental results presented have been obtained in sea-level tunnels. Recommendations are given regarding which scaling methods to use for both size scaling and test-condition scaling, and icing test results are described to support those recommendations. Facility limitations and size-scaling restrictions are discussed. Finally, appendices summarize the air, water and ice properties used in NASA scaling studies, give expressions for each of the similarity parameters used and provide sample calculations for the size-scaling and test-condition scaling methods advocated.

  13. Battery equalization active methods

    NASA Astrophysics Data System (ADS)

    Gallardo-Lozano, Javier; Romero-Cadaval, Enrique; Milanes-Montero, M. Isabel; Guerrero-Martinez, Miguel A.

    2014-01-01

    Many different battery technologies are available for the applications which need energy storage. New researches are being focused on Lithium-based batteries, since they are becoming the most viable option for portable energy storage applications. As most of the applications need series battery strings to meet voltage requirements, battery imbalance is an important matter to be taken into account, since it leads the individual battery voltages to drift apart over time, and premature cells degradation, safety hazards, and capacity reduction will occur. A large number of battery equalization methods can be found, which present different advantages/disadvantages and are suitable for different applications. The present paper presents a summary, comparison and evaluation of the different active battery equalization methods, providing a table that compares them, which is helpful to select the suitable equalization method depending on the application. By applying the same weight to the different parameters of comparison, switch capacitor and double-tiered switching capacitor have the highest ratio. Cell bypass methods are cheap and cell to cell ones are efficient. Cell to pack, pack to cell and cell to pack to cell methods present a higher cost, size, and control complexity, but relatively low voltage and current stress in high-power applications.

  14. Methods of Melanoma Detection.

    PubMed

    Leachman, Sancy A; Cassidy, Pamela B; Chen, Suephy C; Curiel, Clara; Geller, Alan; Gareau, Daniel; Pellacani, Giovanni; Grichnik, James M; Malvehy, Josep; North, Jeffrey; Jacques, Steven L; Petrie, Tracy; Puig, Susana; Swetter, Susan M; Tofte, Susan; Weinstock, Martin A

    2016-01-01

    Detection and removal of melanoma, before it has metastasized, dramatically improves prognosis and survival. The purpose of this chapter is to (1) summarize current methods of melanoma detection and (2) review state-of-the-art detection methods and technologies that have the potential to reduce melanoma mortality. Current strategies for the detection of melanoma range from population-based educational campaigns and screening to the use of algorithm-driven imaging technologies and performance of assays that identify markers of transformation. This chapter will begin by describing state-of-the-art methods for educating and increasing awareness of at-risk individuals and for performing comprehensive screening examinations. Standard and advanced photographic methods designed to improve reliability and reproducibility of the clinical examination will also be reviewed. Devices that magnify and/or enhance malignant features of individual melanocytic lesions (and algorithms that are available to interpret the results obtained from these devices) will be compared and contrasted. In vivo confocal microscopy and other cellular-level in vivo technologies will be compared to traditional tissue biopsy, and the role of a noninvasive "optical biopsy" in the clinical setting will be discussed. Finally, cellular and molecular methods that have been applied to the diagnosis of melanoma, such as comparative genomic hybridization (CGH), fluorescent in situ hybridization (FISH), and quantitative reverse transcriptase polymerase chain reaction (qRT-PCR), will be discussed. PMID:26601859

  15. Shape Bonding method

    NASA Technical Reports Server (NTRS)

    Pontius, James T. (Inventor)

    2010-01-01

    The present invention is directed to a method of bonding at least two surfaces together. The methods step of the present invention include applying a strip of adhesive to a first surface along a predefined outer boundary of a bond area and thereby defining a remaining open area there within. A second surface, or gusset plate, is affixed onto the adhesive before the adhesive cures. The strip of adhesive is allowed to cure and then a second amount of adhesive is applied to cover the remaining open area and substantially fill a void between said first and second surfaces about said bond area. A stencil may be used to precisely apply the strip of adhesive. When the strip cures, it acts as a dam to prevent overflow of the subsequent application of adhesive to undesired areas. The method results in a precise bond area free of undesired shapes and of a preferred profile which eliminate the drawbacks of the prior art bonds.

  16. Actinide extraction methods

    DOEpatents

    Peterman, Dean R [Idaho Falls, ID; Klaehn, John R [Idaho Falls, ID; Harrup, Mason K [Idaho Falls, ID; Tillotson, Richard D [Moore, ID; Law, Jack D [Pocatello, ID

    2010-09-21

    Methods of separating actinides from lanthanides are disclosed. A regio-specific/stereo-specific dithiophosphinic acid having organic moieties is provided in an organic solvent that is then contacted with an acidic medium containing an actinide and a lanthanide. The method can extend to separating actinides from one another. Actinides are extracted as a complex with the dithiophosphinic acid. Separation compositions include an aqueous phase, an organic phase, dithiophosphinic acid, and at least one actinide. The compositions may include additional actinides and/or lanthanides. A method of producing a dithiophosphinic acid comprising at least two organic moieties selected from aromatics and alkyls, each moiety having at least one functional group is also disclosed. A source of sulfur is reacted with a halophosphine. An ammonium salt of the dithiophosphinic acid product is precipitated out of the reaction mixture. The precipitated salt is dissolved in ether. The ether is removed to yield the dithiophosphinic acid.

  17. Multiple detectors "Influence Method".

    PubMed

    Rios, I J; Mayer, R E

    2016-05-01

    The "Influence Method" is conceived for the absolute determination of a nuclear particle flux in the absence of known detector efficiency and without the need to register coincidences of any kind. This method exploits the influence of the presence of one detector in the count rate of another detector, when they are placed one behind the other and define statistical estimators for the absolute number of incident particles and for the efficiency (Rios and Mayer, 2015a). Its detailed mathematical description was recently published (Rios and Mayer, 2015b) and its practical implementation in the measurement of a moderated neutron flux arising from an isotopic neutron source was exemplified in (Rios and Mayer, 2016). With the objective of further reducing the measurement uncertainties, in this article we extend the method for the case of multiple detectors placed one behind the other. The new estimators for the number of particles and the detection efficiency are herein derived. PMID:26943904

  18. Methods of forming steel

    DOEpatents

    Branagan, Daniel J.; Burch, Joseph V.

    2001-01-01

    In one aspect, the invention encompasses a method of forming a steel. A metallic glass is formed and at least a portion of the glass is converted to a crystalline steel material having a nanocrystalline scale grain size. In another aspect, the invention encompasses another method of forming a steel. A molten alloy is formed and cooled the alloy at a rate which forms a metallic glass. The metallic glass is devitrified to convert the glass to a crystalline steel material having a nanocrystalline scale grain size. In yet another aspect, the invention encompasses another method of forming a steel. A first metallic glass steel substrate is provided, and a molten alloy is formed over the first metallic glass steel substrate to heat and devitrify at least some of the underlying metallic glass of the substrate.

  19. Method of grid generation

    DOEpatents

    Barnette, Daniel W.

    2002-01-01

    The present invention provides a method of grid generation that uses the geometry of the problem space and the governing relations to generate a grid. The method can generate a grid with minimized discretization errors, and with minimal user interaction. The method of the present invention comprises assigning grid cell locations so that, when the governing relations are discretized using the grid, at least some of the discretization errors are substantially zero. Conventional grid generation is driven by the problem space geometry; grid generation according to the present invention is driven by problem space geometry and by governing relations. The present invention accordingly can provide two significant benefits: more efficient and accurate modeling since discretization errors are minimized, and reduced cost grid generation since less human interaction is required.

  20. Membrane Protein Prediction Methods

    PubMed Central

    Punta, Marco; Forrest, Lucy R.; Bigelow, Henry; Kernytsky, Andrew; Liu, Jinfeng; Rost, Burkhard

    2007-01-01

    We survey computational approaches that tackle membrane protein structure and function prediction. While describing the main ideas that have led to the development of the most relevant and novel methods, we also discuss pitfalls, provide practical hints and highlight the challenges that remain. The methods covered include: sequence alignment, motif search, functional residue identification, transmembrane segment and protein topology predictions, homology and ab initio modeling. Overall, predictions of functional and structural features of membrane proteins are improving, although progress is hampered by the limited amount of high-resolution experimental information available. While predictions of transmembrane segments and protein topology rank among the most accurate methods in computational biology, more attention and effort will be required in the future to ameliorate database search, homology and ab initio modeling. PMID:17367718

  1. Bayesian Methods in Cosmology

    NASA Astrophysics Data System (ADS)

    Hobson, Michael P.; Jaffe, Andrew H.; Liddle, Andrew R.; Mukherjee, Pia; Parkinson, David

    2014-02-01

    Preface; Part I. Methods: 1. Foundations and algorithms John Skilling; 2. Simple applications of Bayesian methods D. S. Sivia and Steve Rawlings; 3. Parameter estimation using Monte Carlo sampling Antony Lewis and Sarah Bridle; 4. Model selection and multi-model interference Andrew R. Liddle, Pia Mukherjee and David Parkinson; 5. Bayesian experimental design and model selection forecasting Roberto Trotta, Martin Kunz, Pia Mukherjee and David Parkinson; 6. Signal separation in cosmology M. P. Hobson, M. A. J. Ashdown and V. Stolyarov; Part II. Applications: 7. Bayesian source extraction M. P. Hobson, Graça Rocha and R. Savage; 8. Flux measurement Daniel Mortlock; 9. Gravitational wave astronomy Neil Cornish; 10. Bayesian analysis of cosmic microwave background data Andrew H. Jaffe; 11. Bayesian multilevel modelling of cosmological populations Thomas J. Loredo and Martin A. Hendry; 12. A Bayesian approach to galaxy evolution studies Stefano Andreon; 13. Photometric redshift estimation: methods and applications Ofer Lahav, Filipe B. Abdalla and Manda Banerji; Index.

  2. Bayesian Methods in Cosmology

    NASA Astrophysics Data System (ADS)

    Hobson, Michael P.; Jaffe, Andrew H.; Liddle, Andrew R.; Mukherjee, Pia; Parkinson, David

    2009-12-01

    Preface; Part I. Methods: 1. Foundations and algorithms John Skilling; 2. Simple applications of Bayesian methods D. S. Sivia and Steve Rawlings; 3. Parameter estimation using Monte Carlo sampling Antony Lewis and Sarah Bridle; 4. Model selection and multi-model interference Andrew R. Liddle, Pia Mukherjee and David Parkinson; 5. Bayesian experimental design and model selection forecasting Roberto Trotta, Martin Kunz, Pia Mukherjee and David Parkinson; 6. Signal separation in cosmology M. P. Hobson, M. A. J. Ashdown and V. Stolyarov; Part II. Applications: 7. Bayesian source extraction M. P. Hobson, Graça Rocha and R. Savage; 8. Flux measurement Daniel Mortlock; 9. Gravitational wave astronomy Neil Cornish; 10. Bayesian analysis of cosmic microwave background data Andrew H. Jaffe; 11. Bayesian multilevel modelling of cosmological populations Thomas J. Loredo and Martin A. Hendry; 12. A Bayesian approach to galaxy evolution studies Stefano Andreon; 13. Photometric redshift estimation: methods and applications Ofer Lahav, Filipe B. Abdalla and Manda Banerji; Index.

  3. Robust iterative methods

    SciTech Connect

    Saadd, Y.

    1994-12-31

    In spite of the tremendous progress achieved in recent years in the general area of iterative solution techniques, there are still a few obstacles to the acceptance of iterative methods in a number of applications. These applications give rise to very indefinite or highly ill-conditioned non Hermitian matrices. Trying to solve these systems with the simple-minded standard preconditioned Krylov subspace methods can be a frustrating experience. With the mathematical and physical models becoming more sophisticated, the typical linear systems which we encounter today are far more difficult to solve than those of just a few years ago. This trend is likely to accentuate. This workshop will discuss (1) these applications and the types of problems that they give rise to; and (2) recent progress in solving these problems with iterative methods. The workshop will end with a hopefully stimulating panel discussion with the speakers.

  4. METHOD OF PRODUCING NEUTRONS

    DOEpatents

    Imhoff, D.H.; Harker, W.H.

    1964-01-14

    This patent relates to a method of producing neutrons in which there is produced a heated plasma containing heavy hydrogen isotope ions wherein heated ions are injected and confined in an elongated axially symmetric magnetic field having at least one magnetic field gradient region. In accordance with the method herein, the amplitude of the field and gradients are varied at an oscillatory periodic frequency to effect confinement by providing proper ratios of rotational to axial velocity components in the motion of said particles. The energetic neutrons may then be used as in a blanket zone containing a moderator and a source fissionable material to produce heat and thermal neutron fissionable materials. (AEC)

  5. FUEL ELEMENT FABRICATION METHOD

    DOEpatents

    Hix, J.N.; Cooley, G.E.; Cunningham, J.E.

    1960-05-31

    A method is given for assembling and fabricating a fuel element comprising a plurality of spaced parallel fuel plates of a bowed configuration supported by and between a pair of transperse aluminum side plates. In this method, a brasing alloy is preplated on one surface of the aluminum side plates in the form of a cladding or layer-of uniform thickness. Grooves are then cut into the side plates through the alloy layer and into the base aluminum which results in the utilization of thinner aluminum side plates since a portion of the necessary groove depth is supplied by the brazing alloy.

  6. Research on teaching methods.

    PubMed

    Oermann, M H

    1990-01-01

    Research on teaching methods in nursing education was categorized into studies on media, CAI, and other nontraditional instructional strategies. While the research differed, some generalizations may be made from the findings. Multimedia, whether it is used for individual or group instruction, is at least as effective as traditional instruction (lecture and lecture-discussion) in promoting cognitive learning, retention of knowledge, and performance. Further study is needed to identify variables that may influence learning and retention. While learner attitudes toward mediated instruction tended to be positive, investigators failed to control for the effect of novelty. Control over intervening variables was lacking in the majority of studies as well. Research indicated that CAI is as effective as other teaching methods in terms of knowledge gain and retention. Attitudes toward CAI tended to be favorable, with similar problems in measurement as those evidenced in studies of media. Chang (1986) also recommends that future research examine the impact of computer-video interactive instruction on students, faculty, and settings. Research is needed on experimental teaching methods, strategies for teaching problem solving and clinical judgment, and ways of improving the traditional lecture and discussion. Limited research in these areas makes generalizations impossible. There is a particular need for research on how to teach students the diagnostic reasoning process and encourage critical thinking, both in terms of appropriate teaching methods and the way in which those strategies should be used. It is interesting that few researchers studied lecture and lecture-discussion except as comparable teaching methods for research on other strategies. Additional research questions may be generated on lecture and discussion in relation to promoting concept learning, an understanding of nursing and other theories, transfer of knowledge, and development of cognitive skills. Few

  7. Method for fusing bone

    DOEpatents

    Mourant, J.R.; Anderson, G.D.; Bigio, I.J.; Johnson, T.M.

    1996-03-12

    The present invention is a method for joining hard tissue which includes chemically removing the mineral matrix from a thin layer of the surfaces to be joined, placing the two bones together, and heating the joint using electromagnetic radiation. The goal of the method is not to produce a full-strength weld of, for example, a cortical bone of the tibia, but rather to produce a weld of sufficient strength to hold the bone halves in registration while either external fixative devices are applied to stabilize the bone segments, or normal healing processes restore full strength to the tibia.

  8. Unorthodox theoretical methods

    SciTech Connect

    Nedd, Sean

    2012-01-01

    The use of the ReaxFF force field to correlate with NMR mobilities of amine catalytic substituents on a mesoporous silica nanosphere surface is considered. The interfacing of the ReaxFF force field within the Surface Integrated Molecular Orbital/Molecular Mechanics (SIMOMM) method, in order to replicate earlier SIMOMM published data and to compare with the ReaxFF data, is discussed. The development of a new correlation consistent Composite Approach (ccCA) is presented, which incorporates the completely renormalized coupled cluster method with singles, doubles and non-iterative triples corrections towards the determination of heats of formations and reaction pathways which contain biradical species.

  9. Contaminant treatment method

    DOEpatents

    Shapiro, Andrew Philip; Thornton, Roy Fred; Salvo, Joseph James

    2003-01-01

    The present invention provides a method for treating contaminated media. The method comprises introducing remediating ions consisting essentially of ferrous ions, and being peroxide-free, in the contaminated media; applying a potential difference across the contaminated media to cause the remediating ions to migrate into contact with contaminants in the contaminated media; chemically degrading contaminants in the contaminated media by contact with the remediating ions; monitoring the contaminated media for degradation products of the contaminants; and controlling the step of applying the potential difference across the contaminated media in response to the step of monitoring.

  10. Spacecraft Attitude Determination Methods

    NASA Technical Reports Server (NTRS)

    Markley, F. Landis; Bauer, Frank H. (Technical Monitor)

    2000-01-01

    This document is presentation in viewgraph form, which outlines the methods of determining spacecraft attitude. The presentation reviews several parameterizations relating to spacecraft attitude, such as Euler's Theorem, Rodriques parameters, and Euler-Rodriques parameters or Quaternion. Onboard attitude determination is the norm, using either single frame or filtering methods. The presentation reviews several mathematical representations of attitude. The mechanisms for determining attitude on board the Hubble Space Telescope, the Tropical Rainfall and Measuring Mission and the Solar Anomalous and Magnetospheric Particle Explorer are reviewed. Wahba's problem, Procrustes Problem, and some solutions are also summarized.

  11. Electrorheological fluids and methods

    SciTech Connect

    Green, Peter F.; McIntyre, Ernest C.

    2015-06-02

    Electrorheological fluids and methods include changes in liquid-like materials that can flow like milk and subsequently form solid-like structures under applied electric fields; e.g., about 1 kV/mm. Such fluids can be used in various ways as smart suspensions, including uses in automotive, defense, and civil engineering applications. Electrorheological fluids and methods include one or more polar molecule substituted polyhedral silsesquioxanes (e.g., sulfonated polyhedral silsesquioxanes) and one or more oils (e.g., silicone oil), where the fluid can be subjected to an electric field.

  12. On Galerkin difference methods

    NASA Astrophysics Data System (ADS)

    Banks, J. W.; Hagstrom, T.

    2016-05-01

    Energy-stable difference methods for hyperbolic initial-boundary value problems are constructed using a Galerkin framework. The underlying basis functions are Lagrange functions associated with continuous piecewise polynomial approximation on a computational grid. Both theoretical and computational evidence shows that the resulting methods possess excellent dispersion properties. In the absence of boundaries the spectral radii of the operators for the first and second derivative matrices are bounded independent of discretization order. With boundaries the spectral radius of the first order derivative matrix appears to be bounded independent of discretization order, and grows only slowly with discretization order for problems in second-order form.

  13. METHOD OF ROLLING URANIUM

    DOEpatents

    Smith, C.S.

    1959-08-01

    A method is described for rolling uranium metal at relatively low temperatures and under non-oxidizing conditions. The method involves the steps of heating the uranium to 200 deg C in an oil bath, withdrawing the uranium and permitting the oil to drain so that only a thin protective coating remains and rolling the oil coated uranium at a temperature of 200 deg C to give about a 15% reduction in thickness at each pass. The operation may be repeated to accomplish about a 90% reduction without edge cracking, checking or any appreciable increase in brittleness.

  14. Methods of visualizing graphs

    DOEpatents

    Wong, Pak C.; Mackey, Patrick S.; Perrine, Kenneth A.; Foote, Harlan P.; Thomas, James J.

    2008-12-23

    Methods for visualizing a graph by automatically drawing elements of the graph as labels are disclosed. In one embodiment, the method comprises receiving node information and edge information from an input device and/or communication interface, constructing a graph layout based at least in part on that information, wherein the edges are automatically drawn as labels, and displaying the graph on a display device according to the graph layout. In some embodiments, the nodes are automatically drawn as labels instead of, or in addition to, the label-edges.

  15. Selection: Evaluation and methods

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Procedures to collect and to analyze data for genetic improvement of dairy cattle are described. Methods of identification and milk recording are presented. Selection traits include production (milk, fat, and protein yields and component percentages), conformation (final score and linear type traits...

  16. Sampling system and method

    DOEpatents

    Decker, David L.; Lyles, Brad F.; Purcell, Richard G.; Hershey, Ronald Lee

    2013-04-16

    The present disclosure provides an apparatus and method for coupling conduit segments together. A first pump obtains a sample and transmits it through a first conduit to a reservoir accessible by a second pump. The second pump further conducts the sample from the reservoir through a second conduit.

  17. Basic Book Repair Methods.

    ERIC Educational Resources Information Center

    Schechter, Abraham A.

    This book addresses some common preservation techniques that invariably become necessary in library and archival collections of any size. The procedures are described in chronological sequence, and photographs show the techniques from the viewpoint of the person actually doing the work. The recommended repair methods can be accomplished using…

  18. Teaching Materials and Methods.

    ERIC Educational Resources Information Center

    Physiologist, 1982

    1982-01-01

    Twelve abstracts of papers presented at the 33rd Annual Fall Meeting of the American Physiological Society are listed, focusing on teaching materials/methods. Topics, among others, include trends in physiology laboratory programs, cardiovascular system model, cardiovascular computer simulation with didactic feedback, and computer generated figures…

  19. Ferrari's Method and Technology

    ERIC Educational Resources Information Center

    Althoen, Steve

    2005-01-01

    Some tips that combine knowledge of mathematics history and technology for adapting Ferrar's method to factor quintics with a TI-83 graphing calculator are presented. A demonstration on the use of the root finder and regression capabilities of the graphing calculator are presented, so that the tips can be easily adapted for any graphing calculator…

  20. Heart imaging method

    DOEpatents

    Collins, H. Dale; Gribble, R. Parks; Busse, Lawrence J.

    1991-01-01

    A method for providing an image of the human heart's electrical system derives time-of-flight data from an array of EKG electrodes and this data is transformed into phase information. The phase information, treated as a hologram, is reconstructed to provide an image in one or two dimensions of the electrical system of the functioning heart.

  1. Photovoltaic device and method

    DOEpatents

    Cleereman, Robert J; Lesniak, Michael J; Keenihan, James R; Langmaid, Joe A; Gaston, Ryan; Eurich, Gerald K; Boven, Michelle L

    2015-01-27

    The present invention is premised upon an improved photovoltaic device ("PVD") and method of use, more particularly to an improved photovoltaic device with an integral locator and electrical terminal mechanism for transferring current to or from the improved photovoltaic device and the use as a system.

  2. Methods of making pyrrolidones

    DOEpatents

    Werpy, Todd; Frye, Jr., John G.; Wang, Yong; Zacher, Alan H.

    2003-10-14

    The present invention provides methods for making N-methylpyrrolidine and analogous compounds via hydrogenation. Novel catalysts for this process, and novel conditions/yields are also described. Other process improvements may include extraction and hydrolysis steps. Some preferred reactions take place in the aqueous phase. Starting materials for making N-methylpyrrolidine may include succinic acid, N-methylsuccinimide, and their analogs.

  3. Methods of making pyrrolidones

    DOEpatents

    Werpy, Todd; Frye, Jr., John G.; Wang, Yong; Zacher, Alan H.

    2004-03-16

    The present invention provides methods for making N-methylpyrrolidine and analogous compounds via hydrogenation. Novel catalysts for this process, and novel conditions/yields are also described. Other process improvements may include extraction and hydrolysis steps. Some preferred reactions take place in the aqueous phase. Starting materials for making N-methylpyrrolidine may include succinic acid, N-methylsuccinimide, and their analogs.

  4. Methods of making pyrrolidones

    DOEpatents

    Werpy, Todd; Frye, Jr., John G.; Wang, Yong; Zacher, Alan H.

    2003-08-05

    The present invention provides methods for making N-methylpyrrolidine and analogous compounds via hydrogenation. Novel catalysts for this process, and novel conditions/yields are also described. Other process improvements may include extraction and hydrolysis steps. Some preferred reactions take place in the aqueous phase. Starting materials for making N-methylpyrrolidine may include succinic acid, N-methylsuccinimide, and their analogs.

  5. Method of purifying isosaccharinate

    DOEpatents

    Rai, Dhanpat; Moore, Robert C.; Tucker, Mark D.

    2010-09-07

    A method of purifying isosaccharinate by mixing sodium carbonate, potassium carbonate, sodium hydroxide or potassium hydroxide with calcium isosaccharinate, removing the precipitated calcium carbonate and adjusting the pH to between approximately 4.5 to 5.0 thereby removing excess carbonate and hydroxide to provide an acidic solution containing isosaccharinate.

  6. Modified Embedded Atom Method

    Energy Science and Technology Software Center (ESTSC)

    2012-08-01

    Interatomic force and energy calculation subroutine to be used with the molecular dynamics simulation code LAMMPS (Ref a.). The code evaluated the total energy and atomic forces (energy gradient) according to a cubic spline-based variant (Ref b.) of the Modified Embedded Atom Method (MEAM) with a additional Stillinger-Weber (SW) contribution.

  7. The Wonder of Method

    ERIC Educational Resources Information Center

    Pearce, Cathie; MacLure, Maggie

    2009-01-01

    Postmodern and deconstructionist approaches are necessarily concerned with "making visible" and working with marginalized "others". This article explores how theory as method might enable us to revisit methodological approaches that have conventionally relied upon semantic readings of the text. Deconstruction clears the way for such approaches…

  8. Coal briquetting methods

    SciTech Connect

    Keller, D.V.; Smith, C.D.

    1980-09-23

    Methods of and apparatus for cleaning coal in which halogenated hydrocarbons are used as parting liquids are disclosed. Various novel techniques, components, and combinations thereof are employed to maximize efficiency; to minimize costs and adverse environmental impacts; to make it possible to recover coal of a character which has heretofore been economically unrecoverable; to produce a superior product; and to reach other worthwhile goals.

  9. Apparent-Dip Methods.

    ERIC Educational Resources Information Center

    Travis, R. B.; Lamar, D. L.

    1987-01-01

    Reviews methods of determining apparent dip and highlights the use of a device which consists of a nomogram printed on a protractor. Explains how the apparent-dip calculator-protractor can be constructed and outlines the steps for its operation. (ML)

  10. METHOD OF CENTRIFUGE OPERATION

    DOEpatents

    Cohen, K.

    1960-05-10

    A method of isotope separation is described in which two streams are flowed axially of, and countercurrently through, a cylindrical centrifuge bowl. Under the influence of a centrifugal field, the light fraction is concentrated in a stream flowing through the central portion of the bowl, whereas the heavy fraction is concentrated in a stream at the periphery thereof.

  11. Fluid dynamics test method

    NASA Technical Reports Server (NTRS)

    Gayman, W. H.

    1974-01-01

    Test method and apparatus determine fluid effective mass and damping in frequency range where effective mass may be considered as total mass less sum of slosh masses. Apparatus is designed so test tank and its mounting yoke are supported from structural test wall by series of flexures.

  12. Methods Of Making Pyrrolidones

    DOEpatents

    Werpy, Todd; Frye, Jr., John G.; Wang, Yong; Zacher, Alan H.

    2003-12-30

    The present invention provides methods for making N-methylpyrrolidine and analogous compounds via hydrogenation. Novel catalysts for this process, and novel conditions/yields are also described. Other process improvements may include extraction and hydrolysis steps. Some preferred reactions take place in the aqueous phase. Starting materials for making N-methylpyrrolidine may include succinic acid, N-methylsuccinimide, and their analogs.

  13. Hydrocarbonaceous material upgrading method

    SciTech Connect

    Brecher, Lee E.; Mones, Charles G.; Guffey, Frank D.

    2015-06-02

    A hydrocarbonaceous material upgrading method may involve a novel combination of heating, vaporizing and chemically reacting hydrocarbonaceous feedstock that is substantially unpumpable at pipeline conditions, and condensation of vapors yielded thereby, in order to upgrade that feedstock to a hydrocarbonaceous material condensate that meets crude oil pipeline specification.

  14. Miracles and Method.

    ERIC Educational Resources Information Center

    Herrick, James A.

    1989-01-01

    Explores how argumentation in the eighteenth-century miracles controversy (a century-long debate in Britain over the reasonableness of revealed religion) exhibited a controlling concern for procedural considerations. Discusses how the Deists and the Orthodox apologists used their argumentative force to advance rival methods for evaluating miracle…

  15. Fuzzy slope stability method

    SciTech Connect

    Kacewicz, M.

    1987-11-01

    An approach for the description of uncertainty in geology using fuzzy-set theory and an example of slope stability problem is presented. Soil parameters may be described by fuzzy sets. The fuzzy method of slope stability estimation is considered and verified in the case of one of Warsaw's (Poland) slopes.

  16. Projecting the Scientific Method.

    ERIC Educational Resources Information Center

    Uthe, R. E.

    2000-01-01

    Describes how the gas laws are an excellent vehicle for introducing the steps of the scientific method. Students can use balloons and a simple apparatus to observe changes in various gas parameters, develop ideas about the changes they see, collect numerical data, test their ideas, derive simple equations for the relationships, and use the…

  17. Soil decontamination method

    SciTech Connect

    Hutter, G.

    1994-01-04

    A method of processing contaminated soil is disclosed whereby the soil in the form of feed stock is heated in a combustion chamber of a processor with the hydrocarbons being evacuated to a condensing system resulting in a petroleum product while the soil feed stock is detoxified in an afterburner to form clean soil for general use. 1 fig.

  18. Extrusion die and method

    DOEpatents

    Lipp, G. Daniel

    1994-05-03

    A method and die apparatus for manufacturing a honeycomb body of triangular cell cross-section and high cell density, the die having a combination of (i) feedholes feeding slot intersections and (ii) feedholes feeding slot segments not supplied from slot intersections, whereby a reduction in feedhole count is achieved while still retaining good extrusion efficiency and extrudate uniformity.

  19. The Effective Equation Method

    NASA Astrophysics Data System (ADS)

    Kuksin, Sergei; Maiocchi, Alberto

    In this chapter we present a general method of constructing the effective equation which describes the behavior of small-amplitude solutions for a nonlinear PDE in finite volume, provided that the linear part of the equation is a hamiltonian system with a pure imaginary discrete spectrum. The effective equation is obtained by retaining only the resonant terms of the nonlinearity (which may be hamiltonian, or may be not); the assertion that it describes the limiting behavior of small-amplitude solutions is a rigorous mathematical theorem. In particular, the method applies to the three- and four-wave systems. We demonstrate that different possible types of energy transport are covered by this method, depending on whether the set of resonances splits into finite clusters (this happens, e.g. in case of the Charney-Hasegawa-Mima equation), or is connected (this happens, e.g. in the case of the NLS equation if the space-dimension is at least two). For equations of the first type the energy transition to high frequencies does not hold, while for equations of the second type it may take place. Our method applies to various weakly nonlinear wave systems, appearing in plasma, meteorology and oceanography.

  20. Biomass treatment method

    DOEpatents

    Friend, Julie; Elander, Richard T.; Tucker, III; Melvin P.; Lyons, Robert C.

    2010-10-26

    A method for treating biomass was developed that uses an apparatus which moves a biomass and dilute aqueous ammonia mixture through reaction chambers without compaction. The apparatus moves the biomass using a non-compressing piston. The resulting treated biomass is saccharified to produce fermentable sugars.

  1. Ergonomics research methods

    NASA Technical Reports Server (NTRS)

    Uspenskiy, S. I.; Yermakova, S. V.; Chaynova, L. D.; Mitkin, A. A.; Gushcheva, T. M.; Strelkov, Y. K.; Tsvetkova, N. F.

    1973-01-01

    Various factors used in ergonomic research are given. They are: (1) anthrometric measurement, (2) polyeffector method of assessing the functional state of man, (3) galvanic skin reaction, (4) pneumography, (5) electromyography, (6) electrooculography, and (7) tachestoscopy. A brief summary is given of each factor and includes instrumentation and results.

  2. Convergence of Arnoldi method

    SciTech Connect

    Nevanlinna, O.

    1994-12-31

    This note summarizes some results on (a monitored version of) the Arnoldi method in Hilbert spaces. The interest in working in infinite dimensional spaces comes partly from the fact that only then can one have meaningful asymptotical statements (which hopefully give some light to the convergence of Arnoldi in large dimensional problems with iteration indices far less than the dimension).

  3. Biotechnology Laboratory Methods.

    ERIC Educational Resources Information Center

    Davis, Robert H.; Kompala, Dhinakar S.

    1989-01-01

    Describes a course entitled "Biotechnology Laboratory" which introduces a variety of laboratory methods associated with biotechnology. Describes the history, content, and seven experiments of the course. The seven experiments are selected from microbiology and molecular biology, kinetics and fermentation, and downstream processing-bioseparations.…

  4. Photovoltaic device and method

    SciTech Connect

    Cleereman, Robert; Lesniak, Michael J.; Keenihan, James R.; Langmaid, Joe A.; Gaston, Ryan; Eurich, Gerald K.; Boven, Michelle L.

    2015-11-24

    The present invention is premised upon an improved photovoltaic device ("PVD") and method of use, more particularly to an improved photovoltaic device with an integral locator and electrical terminal mechanism for transferring current to or from the improved photovoltaic device and the use as a system.

  5. Teaching Materials and Methods.

    ERIC Educational Resources Information Center

    Physiologist, 1987

    1987-01-01

    Contains abstracts of presented papers which deal with teaching materials and methods in physiology. Includes papers on preconceptual notions in physiology, somatosensory activity recorded in the dorsal root ganglion of the bull frog, and the use of the Apple Macintosh microcomputer in teaching human anatomy and physiology. (TW)

  6. Nonparametric Methods in Reliability

    PubMed Central

    Hollander, Myles; Peña, Edsel A.

    2005-01-01

    Probabilistic and statistical models for the occurrence of a recurrent event over time are described. These models have applicability in the reliability, engineering, biomedical and other areas where a series of events occurs for an experimental unit as time progresses. Nonparametric inference methods, in particular, the estimation of a relevant distribution function, are described. PMID:16710444

  7. Method of photocatalytic nanotagging

    DOEpatents

    Shelnutt, John A.; Medforth, Craig J.; Song, Yujiang

    2010-04-27

    A nanotagged chemical structure comprising a chemical structure with an associated photocatalyst and a tagging nanoparticle (a nanotag) grown in proximity to the photocatalyst, and a method for making the nanotagged chemical structure. The nanoparticle is grown in proximity to the photocatalyst by using a photocatalytic reduction reaction.

  8. The power of methods.

    PubMed

    Weissmann, Charles

    2013-11-01

    Major advances in science are usually launched by new methods or techniques. Because this essay is not intended as a history of science, I shall not invoke the invention of the microscope or telescope as the gateways to inner and outer space, but will restrict myself to developments I have witnessed, or almost witnessed, during my scientific lifetime. PMID:24055872

  9. Coating method for graphite

    DOEpatents

    Banker, John G.; Holcombe, Jr., Cressie E.

    1977-01-01

    A method of limiting carbon contamination from graphite ware used in induction melting of uranium alloys is provided comprising coating the graphite surface with a suspension of Y.sub.2 O.sub.3 particles in water containing about 1.5 to 4% by weight sodium carboxymethylcellulose.

  10. Coating method for graphite

    DOEpatents

    Banker, J.G.; Holcombe, C.E. Jr.

    1975-11-06

    A method of limiting carbon contamination from graphite ware used in induction melting of uranium alloys is provided. The graphite surface is coated with a suspension of Y/sub 2/O/sub 3/ particles in water containing about 1.5 to 4 percent by weight sodium carboxymethylcellulose.

  11. Seismic Inversion Methods

    SciTech Connect

    Jackiewicz, Jason

    2009-09-16

    With the rapid advances in sophisticated solar modeling and the abundance of high-quality solar pulsation data, efficient and robust inversion techniques are crucial for seismic studies. We present some aspects of an efficient Fourier Optimally Localized Averaging (OLA) inversion method with an example applied to time-distance helioseismology.

  12. Method for forming ammonia

    DOEpatents

    Kong, Peter C.; Pink, Robert J.; Zuck, Larry D.

    2008-08-19

    A method for forming ammonia is disclosed and which includes the steps of forming a plasma; providing a source of metal particles, and supplying the metal particles to the plasma to form metal nitride particles; and providing a substance, and reacting the metal nitride particles with the substance to produce ammonia, and an oxide byproduct.

  13. Neurological Impress Method plus

    ERIC Educational Resources Information Center

    Flood, James; Lapp, Diane; Fisher, Douglas

    2005-01-01

    The purpose of these two studies was to redirect interest to the Neurological Impress Method, a multisensory approach to reading instruction that occurs between a teacher and a student, which has been largely forgotten in mainstream and special education circles over the past decades. In addition to its emphasis on oral reading, we included a…

  14. Research Methods in Sociolinguistics

    ERIC Educational Resources Information Center

    Hernández-Campoy, Juan Manuel

    2014-01-01

    The development of Sociolinguistics has been qualitatively and quantitatively outstanding within Linguistic Science since its beginning in the 1950s, with a steady growth in both theoretical and methodological developments as well as in its interdisciplinary directions within the spectrum of language and society. Field methods in sociolinguistic…

  15. Truth and Methods.

    ERIC Educational Resources Information Center

    Dasenbrock, Reed Way

    1995-01-01

    Examines literary theory's displacing of "method" in the New Historicist criticism. Argues that Stephen Greenblatt and Lee Paterson imply that no objective historical truth is possible and as a result do not give methodology its due weight in their criticism. Questions the theory of "truth" advanced in this vein of literary criticism. (TB)

  16. Compton scattering study and electronic structure of different phases of NH4NO3

    NASA Astrophysics Data System (ADS)

    Jain, Pradeep; Sahariya, Jagrati; Ahuja, B. L.

    2013-06-01

    In this paper, we present energy bands, density of states and the nature of hydrogen bonding in different temperature-dependent phases of NH4NO3, namely phases II (357-398 K), III (305-357 K) and IV (257-305 K), using the full potential linearized augmented plane wave and linear combination of atomic orbitals (LCAO) methods. Both band structure calculations show the insulating character of the II-IV phases of NH4NO3. In addition, we have reported the isotropic Compton profile of NH4NO3(IV) measured using 661.65 keV γ-radiation from a 137Cs isotope. The experimental momentum density has been compared with that based on density functional theory (DFT) and Hartree-Fock schemes within the LCAO method. It is seen that the LCAO with hybridization of DFT and Hartree-Fock (so-called B3LYP) gives better agreement with the present Compton profile measurement.

  17. Compton profiles and electronic structure of monoclinic zinc and cadmium tungstates

    NASA Astrophysics Data System (ADS)

    Meena, B. S.; Heda, N. L.; Mund, H. S.; Ahuja, B. L.

    2015-12-01

    We report the first ever Compton scattering study of ZnWO4 and CdWO4 using 20 Ci 137Cs Compton spectrometer at momentum resolution of 0.34 a.u. To compare the experimental Compton profiles, we have also deduced the momentum densities using density functional theory (DFT) within linear combination of atomic orbitals (LCAO) methods. It is seen that the experimental Compton profiles of both the tungstates give a better agreement with LCAO-DFT calculations within generalized gradient approximation (GGA) employing Perdew-Becke-Ernzerhof (PBE) exchange and correlation energies than other approximations included in the present work. Further, energy bands, density of states (DOS) and band gaps have also been calculated using LCAO-DFT-GGA-PBE scheme and full potential linearized augmented plane wave method. Both the computational schemes show a semiconducting nature of both the tungstates, with a direct band gap at Y point of Brillouin zone. Further, a relative nature of bonding on equal-valence-electron-density scale shows more covalent character in ZnWO4 than CdWO4 which reconciles with the conclusions drawn using integrated DOS and Mulliken's population data.

  18. Nonhazardous Urine Pretreatment Method

    NASA Technical Reports Server (NTRS)

    Akse, James R.; Holtsnider, John T.

    2012-01-01

    A method combines solid phase acidification with two non-toxic biocides to prevent ammonia volatilization and microbial proliferation. The safe, non-oxidizing biocide combination consists of a quaternary amine and a food preservative. This combination has exhibited excellent stabilization of both acidified and unacidified urine. During pretreatment tests, composite urine collected from donors was challenged with a microorganism known to proliferate in urine, and then was processed using the nonhazardous urine pre-treatment method. The challenge microorganisms included Escherichia coli, a common gram-negative bacteria; Enterococcus faecalis, a ureolytic gram-positive bacteria; Candida albicans, a yeast commonly found in urine; and Aspergillus niger, a problematic mold that resists urine pre-treatment. Urine processed in this manner remained microbially stable for over 57 days. Such effective urine stabilization was achieved using non-toxic, non-oxidizing biocides at higher pH (3.6 to 5.8) than previous methods in use or projected for use aboard the International Space Station (ISS). ISS urine pretreatment methods employ strong oxidants including ozone and hexavalent chromium (Cr(VI)), a carcinogenic material, under very acidic conditions (pH = 1.8 to 2.4). The method described here offers a much more benign chemical environment than previous pretreatment methods, and will lower equivalent system mass (ESM) by reducing containment volume and mass, system complexity, and crew time needed to handle pre-treatment chemicals. The biocides, being non-oxidizing, minimize the potential for chemical reactions with urine constituents to produce volatile, airborne contaminants such as cyanogen chloride. Additionally, the biocides are active under significantly less acidic conditions than those used in the current system, thereby reducing the degree of required acidification. A simple flow-through solid phase acidification (SPA) bed is employed to overcome the natural buffering

  19. Ion sensing method

    DOEpatents

    Smith, Richard Harding; Martin, Glenn Brian

    2004-05-18

    The present invention allows the determination of trace levels of ionic substances in a sample solution (ions, metal ions, and other electrically charged molecules) by coupling a separation method, such as liquid chromatography, with ion selective electrodes (ISE) prepared so as to allow detection at activities below 10.sup.-6 M. The separation method distributes constituent molecules into fractions due to unique chemical and physical properties, such as charge, hydrophobicity, specific binding interactions, or movement in an electrical field. The separated fractions are detected by means of the ISE(s). These ISEs can be used singly or in an array. Accordingly, modifications in the ISEs are used to permit detection of low activities, specifically, below 10.sup.-6 M, by using low activities of the primary analyte (the molecular species which is specifically detected) in the inner filling solution of the ISE. Arrays constructed in various ways allow flow-through sensing for multiple ions.

  20. Glycoconjugates and methods

    SciTech Connect

    Bertozzi, Carolyn; Yarema, Kevin J.; Mahal, Lara K.

    2000-01-01

    Methods for making the functionalized glycoconjugates include (a) contacting a cell with a first monosaccharide, and (b) incubating the cell under conditions whereby the cell (i) internalizes the first monosaccharide, (ii) biochemically processes the first monosaccharide into a second saccharide, (iii) conjugates the saccharide to a carrier to form a glycoconjugate, and (iv) extracellularly expresses the glycoconjugate to form an extracellular glycoconjugate comprising a selectively reactive functional group. Methods for forming products at a cell further comprise contacting the functional group of the extracellularly expressed glycoconjugate with an agent which selectively reacts with the functional group to form a product. Subject compositions include cyto-compatible monosaccharides comprising a nitrogen or ether linked functional group selectively reactive at a cell surface and compositions and cells comprising such saccharides.

  1. Glycoconjugates and methods

    DOEpatents

    Bertozzi, Carolyn C.; Yarema, Kevin J.; Mahal, Lara K.

    2008-04-01

    Methods for making the functionalized glycoconjugates include (a) contacting a cell with a first monosaccharide, and (b) incubating the cell under conditions whereby the cell (i) internalizes the first monosaccharide, (ii) biochemically processes the first monosaccharide into a second saccharide, (iii) conjugates the saccharide to a carrier to form a glycoconjugate, and (iv) extracellularly expresses the glycoconjugate to form an extracellular glycoconjugate comprising a selectively reactive functional group. Methods for forming products at a cell further comprise contacting the functional group of the extracellularly expressed glycoconjugate with an agent which selectively reacts with the functional group to form a product. Subject compositions include cyto-compatible monosaccharides comprising a nitrogen or ether linked functional group selectively reactive at a cell surface and compositions and cells comprising such saccharides.

  2. Glycoconjugates And Methods

    SciTech Connect

    Bertozzi, Carolyn; Yarema, Kevin J.; Mahal, Lara K.

    2005-08-30

    Methods for making the functionalized glycoconjugates include (a) contacting a cell with a first monosaccharide, and (b) incubating the cell under conditions whereby the cell (i) internalizes the first monosaccharide, (ii) biochemically processes the first monosaccharide into a second saccharide, (iii) conjugates the saccharide to a carrier to form a glycoconjugate, and (iv) extracellularly expresses the glycoconjugate to form an extracellular glycoconjugate comprising a selectively reactive functional group. Methods for forming products at a cell further comprise contacting the functional group of the extracellularly expressed glycoconjugate with an agent which selectively reacts with the functional group to form a product. Subject compositions include cyto-compatible monosaccharides comprising a nitrogen or ether linked functional group selectively reactive at a cell surface and compositions and cells comprising such saccharides.

  3. Glycoconjugates and methods

    SciTech Connect

    Bertozzi, Carolyn; Yarema, Kevin J.; Mahal, Lara K.

    2002-10-01

    Methods for making the functionalized glycoconjugates include (a) contacting a cell with a first monosaccharide, and (b) incubating the cell under conditions whereby the cell (i) internalizes the first monosaccharide, (ii) biochemically processes the first monosaccharide into a second saccharide, (iii) conjugates the saccharide to a carrier to form a glycoconjugate, and (iv) extracellularly expresses the glycoconjugate to form an extracellular glycoconjugate comprising a selectively reactive functional group. Methods for forming products at a cell further comprise contacting the functional group of the extracellularly expressed glycoconjugate with an agent which selectively reacts with the functional group to form a product. Subject compositions include cyto-compatible monosaccharides comprising a nitrogen or ether linked functional group selectively reactive at a cell surface and compositions and cells comprising such saccharides.

  4. Biological tracer method

    DOEpatents

    Strong-Gunderson, Janet M.; Palumbo, Anthony V.

    1998-01-01

    The present invention is a biological tracer method for characterizing the movement of a material through a medium, comprising the steps of: introducing a biological tracer comprising a microorganism having ice nucleating activity into a medium; collecting at least one sample of the medium from a point removed from the introduction point; and analyzing the sample for the presence of the biological tracer. The present invention is also a method for using a biological tracer as a label for material identification by introducing a biological tracer having ice nucleating activity into a material, collecting a sample of a portion of the labelled material and analyzing the sample for the presence of the biological tracer.

  5. Biological tracer method

    DOEpatents

    Strong-Gunderson, J.M.; Palumbo, A.V.

    1998-09-15

    The present invention is a biological tracer method for characterizing the movement of a material through a medium, comprising the steps of: introducing a biological tracer comprising a microorganism having ice nucleating activity into a medium; collecting at least one sample of the medium from a point removed from the introduction point; and analyzing the sample for the presence of the biological tracer. The present invention is also a method for using a biological tracer as a label for material identification by introducing a biological tracer having ice nucleating activity into a material, collecting a sample of a portion of the labelled material and analyzing the sample for the presence of the biological tracer. 2 figs.

  6. Implementation of Rosenbrock methods

    SciTech Connect

    Shampine, L. F.

    1980-11-01

    Rosenbrock formulas have shown promise in research codes for the solution of initial-value problems for stiff systems of ordinary differential equations (ODEs). To help assess their practical value, the author wrote an item of mathematical software based on such a formula. This required a variety of algorithmic and software developments. Those of general interest are reported in this paper. Among them is a way to select automatically, at every step, an explicit Runge-Kutta formula or a Rosenbrock formula according to the stiffness of the problem. Solving linear systems is important to methods for stiff ODEs, and is rather special for Rosenbrock methods. A cheap, effective estimate of the condition of the linear systems is derived. Some numerical results are presented to illustrate the developments.

  7. Cold isopressing method

    DOEpatents

    Chen, Jack C.; Stawisuck, Valerie M.; Prasad, Ravi

    2003-01-01

    A cold isopressing method in which two or more layers of material are formed within an isopressing mold. One of the layers consists of a tape-cast film. The layers are isopressed within the isopressing mold, thereby to laminate the layers and to compact the tape-cast film. The isopressing mold can be of cylindrical configuration with the layers being coaxial cylindrical layers. The materials used in forming the layers can contain green ceramic materials and the resultant structure can be fired and sintered as necessary and in accordance with known methods to produce a finished composite, ceramic structure. Further, such green ceramic materials can be of the type that are capable of conducting hydrogen or oxygen ions at high temperature with the object of utilizing the finished composite ceramic structure as a ceramic membrane element.

  8. Motor degradation prediction methods

    SciTech Connect

    Arnold, J.R.; Kelly, J.F.; Delzingaro, M.J.

    1996-12-01

    Motor Operated Valve (MOV) squirrel cage AC motor rotors are susceptible to degradation under certain conditions. Premature failure can result due to high humidity/temperature environments, high running load conditions, extended periods at locked rotor conditions (i.e. > 15 seconds) or exceeding the motor`s duty cycle by frequent starts or multiple valve stroking. Exposure to high heat and moisture due to packing leaks, pressure seal ring leakage or other causes can significantly accelerate the degradation. ComEd and Liberty Technologies have worked together to provide and validate a non-intrusive method using motor power diagnostics to evaluate MOV rotor condition and predict failure. These techniques have provided a quick, low radiation dose method to evaluate inaccessible motors, identify degradation and allow scheduled replacement of motors prior to catastrophic failures.

  9. Proximal Point Methods Revisited

    NASA Astrophysics Data System (ADS)

    Boikanyo, Oganeditse A.; Moroşanu, Gheorghe

    2011-09-01

    The proximal point methods have been widely used in the last decades to approximate the solutions of nonlinear equations associated with monotone operators. Inspired by the iterative procedure defined by B. Martinet (1970), R.T. Rockafellar introduced in 1976 the so-called proximal point algorithm (PPA) for a general maximal monotone operator. The sequence generated by this iterative method is weakly convergent under appropriate conditions, but not necessarily strongly convergent, as proved by O. Güler (1991). This fact explains the introduction of different modified versions of the PPA which generate strongly convergent sequences under appropriate conditions, including the contraction-PPA defined by H.K. Xu in 2002. Here we discuss Xu's modified PPA as well as some of its generalizations. Special attention is paid to the computational errors, in particular the original Rockafellar summability assumption is replaced by the condition that the error sequence converges to zero strongly.

  10. Thin wire pointing method

    NASA Technical Reports Server (NTRS)

    Green, G.; Mattauch, R. J. (Inventor)

    1983-01-01

    A method is described for forming sharp tips on thin wires, in particular phosphor bronze wires of diameters such as one-thousandth inch used to contact micron size Schottky barrier diodes, which enables close control of tip shape and which avoids the use of highly toxic solutions. The method includes dipping an end of a phosphor bronze wire into a dilute solution of sulfamic acid and applying a current through the wire to electrochemically etch it. The humidity in the room is controlled to a level of less than 50%, and the voltage applied between the wire and another electrode in the solutions is a half wave rectified voltage. The current through the wire is monitored, and the process is stopped when the current falls to a predetermined low level.

  11. Groundwater contamination field methods

    NASA Astrophysics Data System (ADS)

    Johnson, Ivan

    Half of the drinking water in the United States comes from groundwater; 75% of the nation's cities obtain all or part of their supplies from groundwater; and the rural areas are 95% dependent upon groundwater. Therefore it is imperative that every possible precaution be taken to protect the purity of the groundwater.Because of the increasing interest in prevention of groundwater contamination and the need for nationally recognized methods for investigation of contamination, a symposium entitled “Field Methods for Groundwater Contamination Studies and Their Standardization” was held February 2-7, 1986, in Cocoa Beach, Fla. The symposium was sponsored and organized by the American Society for Testing and Materials (ASTM) Committee D18 on Soil and Rock and Committee D19 on Water. Gene Collins of the National Institute for Petroleum and Energy Research (Bartlesville, Okla.) was symposium chair, and Ivan Johnson (A. Ivan Johnson, Inc., Consulting, Arvada, Colo.) was vice chair.

  12. Barrier methods of contraception.

    PubMed

    Skrine, R L

    1985-05-01

    Barrier methods of contraception make up an essential part of the present contraceptive range, and doctors need to know in detail how to choose and fit them as well as how to instruct patients in their use. This discussion reviews the mode of action of the barrier method and then focuses on the vaginal diaphragm, the cervical or vault cap, the collatex (Today) sponge, condoms, emotionl problems associated with the use of barrier methods, advantages of barrier methods, and future developments. Barrier methods of contraception are only effective if used consistently and carefully. Failure rates vary greatly between studies, but in selected populations the failure rate for the diaphragm with spermicide can be as low as 1.9/100 woman years (wy) and for the condom 3.6 per 100wy (Vessey et al., 1982). If known user failures are removed, the figure for the condom can drop to as low as 0.4 per 100wy (John, 1973), which compares favorably with that of the combined oral contraceptive. Other studies quote failure rates of 10 per 100wy or more. These methods call for considerable participation by the patient at or before each act of intercourse and there is, therefore, great scope for inefficient use, either as a result of poor instruction or because couples find that they interfere with happy, relaxed sexual activity -- or fear that they may do so. Doctors need to understand the feelings of their patients before recommending them. The aim of a barrier method is to prevent live sperm from meeting the ovum. This is accomplished by the combination of a physical barrier with a spermicide. In the case of the condom, the integrity of the physical barrier is the most important factor, although some patients feel more secure with an additional spermicide. The vaginal barriers used at present do not produce a "water-tight" fit, and the principle is that the spermicide is held over the cervix by the barrier. It is also possible that the device acts partially by holding the alkaline

  13. The shifted penalty method

    NASA Astrophysics Data System (ADS)

    Zavarise, Giorgio

    2015-07-01

    The method presented here is a variation of the classical penalty one, suited to reduce penetration of the contacting surfaces. The slight but crucial modification concerns the introduction of a shift parameter that moves the minimum point of the constrained potential toward the exact value, without any penalty increase. With respect to the classical augmentation procedures, the solution improvement is embedded within the original penalty contribution. The problem is almost consistently linearized, and the shift is updated before each Newton's iteration. However, adding few iterations, with respect to the original penalty method, a reduction of the penetration of several orders of magnitude can be achieved. The numerical tests have shown very attractive characteristics and very stable solution paths. This permits to foresee a wide area of applications, not only in contact mechanics, but for any problem, like e.g. incompressible materials, where a penalty contribution is required.

  14. Methods for forming particles

    DOEpatents

    Fox, Robert V.; Zhang, Fengyan; Rodriguez, Rene G.; Pak, Joshua J.; Sun, Chivin

    2016-06-21

    Single source precursors or pre-copolymers of single source precursors are subjected to microwave radiation to form particles of a I-III-VI.sub.2 material. Such particles may be formed in a wurtzite phase and may be converted to a chalcopyrite phase by, for example, exposure to heat. The particles in the wurtzite phase may have a substantially hexagonal shape that enables stacking into ordered layers. The particles in the wurtzite phase may be mixed with particles in the chalcopyrite phase (i.e., chalcopyrite nanoparticles) that may fill voids within the ordered layers of the particles in the wurtzite phase thus produce films with good coverage. In some embodiments, the methods are used to form layers of semiconductor materials comprising a I-III-VI.sub.2 material. Devices such as, for example, thin-film solar cells may be fabricated using such methods.

  15. Die singulation method

    SciTech Connect

    Swiler, Thomas P; Garcia, Ernest J; Francis, Kathryn M

    2014-01-07

    A method is disclosed for singulating die from a semiconductor substrate (e.g. a semiconductor-on-insulator substrate or a bulk silicon substrate) containing an oxide layer (e.g. silicon dioxide or a silicate glass) and one or more semiconductor layers (e.g. monocrystalline or polycrystalline silicon) located above the oxide layer. The method etches trenches through the substrate and through each semiconductor layer about the die being singulated, with the trenches being offset from each other around at least a part of the die so that the oxide layer between the trenches holds the substrate and die together. The trenches can be anisotropically etched using a Deep Reactive Ion Etching (DRIE) process. After the trenches are etched, the oxide layer between the trenches can be etched away with a HF etchant to singulate the die. A release fixture can be located near one side of the substrate to receive the singulated die.

  16. Die singulation method

    SciTech Connect

    Swiler, Thomas P.; Garcia, Ernest J.; Francis, Kathryn M.

    2013-06-11

    A method is disclosed for singulating die from a semiconductor substrate (e.g. a semiconductor-on-insulator substrate or a bulk silicon substrate) containing an oxide layer (e.g. silicon dioxide or a silicate glass) and one or more semiconductor layers (e.g. monocrystalline or polycrystalline silicon) located above the oxide layer. The method etches trenches through the substrate and through each semiconductor layer about the die being singulated, with the trenches being offset from each other around at least a part of the die so that the oxide layer between the trenches holds the substrate and die together. The trenches can be anisotropically etched using a Deep Reactive Ion Etching (DRIE) process. After the trenches are etched, the oxide layer between the trenches can be etched away with an HF etchant to singulate the die. A release fixture can be located near one side of the substrate to receive the singulated die.

  17. Comprehensive rotorcraft analysis methods

    NASA Technical Reports Server (NTRS)

    Stephens, Wendell B.; Austin, Edward E.

    1988-01-01

    The development and application of comprehensive rotorcraft analysis methods in the field of rotorcraft technology are described. These large scale analyses and the resulting computer programs are intended to treat the complex aeromechanical phenomena that describe the behavior of rotorcraft. They may be used to predict rotor aerodynamics, acoustic, performance, stability and control, handling qualities, loads and vibrations, structures, dynamics, and aeroelastic stability characteristics for a variety of applications including research, preliminary and detail design, and evaluation and treatment of field problems. The principal comprehensive methods developed or under development in recent years and generally available to the rotorcraft community because of US Army Aviation Research and Technology Activity (ARTA) sponsorship of all or part of the software systems are the Rotorcraft Flight Simulation (C81), Dynamic System Coupler (DYSCO), Coupled Rotor/Airframe Vibration Analysis Program (SIMVIB), Comprehensive Analytical Model of Rotorcraft Aerodynamics and Dynamics (CAMRAD), General Rotorcraft Aeromechanical Stability Program (GRASP), and Second Generation Comprehensive Helicopter Analysis System (2GCHAS).

  18. Inspection system calibration methods

    DOEpatents

    Deason, Vance A.; Telschow, Kenneth L.

    2004-12-28

    An inspection system calibration method includes producing two sideband signals of a first wavefront; interfering the two sideband signals in a photorefractive material, producing an output signal therefrom having a frequency and a magnitude; and producing a phase modulated operational signal having a frequency different from the output signal frequency, a magnitude, and a phase modulation amplitude. The method includes determining a ratio of the operational signal magnitude to the output signal magnitude, determining a ratio of a 1st order Bessel function of the operational signal phase modulation amplitude to a 0th order Bessel function of the operational signal phase modulation amplitude, and comparing the magnitude ratio to the Bessel function ratio.

  19. Review of Godunov Methods

    NASA Technical Reports Server (NTRS)

    Holt, Maurice

    1996-01-01

    In this paper, second order Godunov methods are reviewed. The early versions by Colella and Woodward (PPM) and van Leer (MUSCL) are described in their original form. The simplification of these by Roe, based on approximate Riemann solver, is then presented. Attention is next given to the improvement in MUSCL due to Hancock and van Leer leading to a fuller paper by Huynh. Finally, brief reference is made to TVD and ENO schemes due to Harten.

  20. Method of infusion extraction

    NASA Technical Reports Server (NTRS)

    Chang-Diaz, Franklin R. (Inventor)

    1989-01-01

    Apparatus and method of removing desirable constituents from an infusible material by infusion extraction, where a piston operating in a first chamber draws a solvent into the first chamber where it may be heated, and then moves the heated solvent into a second chamber containing the infusible material, and where infusion extraction takes place. The piston then moves the solvent containing the extract through a filter into the first chamber, leaving the extraction residue in the second chamber.

  1. Extrusion die and method

    DOEpatents

    Lipp, G. Daniel

    1994-04-26

    A method and die apparatus for manufacturing a honeycomb body of rhombic cell cross-section by extrusion through an extrusion die of triangular cell discharge slot configuration, the die incorporating feedholes at selected slot intersections only, such that slot segments communicating directly with the feedholes discharge web material and slot segments not so connected do not discharge web material, whereby a rhombic cell cross-section in the extruded body is provided.

  2. Method of producing imines

    DOEpatents

    Sithambaram, Shanthakumar; Son, Young-Chan; Suib, Steven L.

    2008-04-08

    A method for forming an imine comprises reacting a first reactant comprising a hydroxyl functionality, a carbonyl functionality, or both a hydroxyl functionality and a carbonyl functionality with a second reactant having an amine functionality in the presence of ordered porous manganese-based octahedral molecular sieves and an oxygen containing gas at a temperature and for a time sufficient for the imine to be produced.

  3. Method for making nanomaterials

    DOEpatents

    Fan, Hongyou; Wu, Huimeng

    2013-06-04

    A method of making a nanostructure by preparing a face centered cubic-ordered metal nanoparticle film from metal nanoparticles, such as gold and silver nanoparticles, exerting a hydrostatic pressure upon the film at pressures of several gigapascals, followed by applying a non-hydrostatic stress perpendicularly at a pressure greater than approximately 10 GPA to form an array of nanowires with individual nanowires having a relatively uniform length, average diameter and density.

  4. GRAPHITE IMPREGNATION METHOD

    DOEpatents

    Kertesz, F.; Buttram, H.J.

    1962-04-24

    ABS>A method for impregnating a refractory material by filling its pores with a first salt having a high melting temperature is described. The salt is mixed with another, more volatile salt, giving the mixture a much lower melting temperature than that of the first salt. The material is coated with the mixture, then heated to drive off the volatile salt, leaving the first salt in place. (AEC)

  5. Method for detecting biomolecules

    DOEpatents

    Huo, Qisheng; Liu, Jun

    2008-08-12

    A method for detecting and measuring the concentration of biomolecules in solution, utilizing a conducting electrode in contact with a solution containing target biomolecules, with a film with controllable pore size distribution characteristics applied to at least one surface of the conducting electrode. The film is functionalized with probe molecules that chemically interact with the target biomolecules at the film surface, blocking indicator molecules present in solution from diffusing from the solution to the electrode, thereby changing the electrochemical response of the electrode

  6. Thermal coupling measurement method

    NASA Technical Reports Server (NTRS)

    Rosenthal, L. A.; Menichelli, V. J.

    1974-01-01

    Heat flow from an embedded heated wire responds to a change in the ambient environment. The wire is part of a self-balancing bridge system, and heat flow is measured directly in watts. Steady-state and transient thermal coupling can be measured directly and is an indication of the thermal resistance and diffusivity for the system under study. The method is applied to an aerospace electroexplosive component.

  7. RUTHENIUM DECONTAMINATION METHOD

    DOEpatents

    Gresky, A.T.

    1960-07-19

    A liquid-liquid extraction method of separating uranium from fission products is given. A small amount of a low molecular weight ketone is added to an acidic aqueous solution containing neutron-irradiated uranium and its associated fission products. The resulting solution is digested and then contacted with an organic liquid that extracts uranium values. The purpose of the step of digesting the aqueous solution in the presence of the ketone is to suppress the extractability of ruthenium.

  8. METHOD OF SEPARATING PLUTONIUM

    DOEpatents

    Heal, H.G.

    1960-02-16

    BS>A method of separating plutonium from aqueous nitrate solutions of plutonium, uranium. and high beta activity fission products is given. The pH of the aqueous solution is adjusted between 3.0 to 6.0 with ammonium acetate, ferric nitrate is added, and the solution is heated to 80 to 100 deg C to selectively form a basic ferric plutonium-carrying precipitate.

  9. Vapor spill monitoring method

    DOEpatents

    Bianchini, Gregory M.; McRae, Thomas G.

    1985-01-01

    Method for continuous sampling of liquified natural gas effluent from a spill pipe, vaporizing the cold liquified natural gas, and feeding the vaporized gas into an infrared detector to measure the gas composition. The apparatus utilizes a probe having an inner channel for receiving samples of liquified natural gas and a surrounding water jacket through which warm water is flowed to flash vaporize the liquified natural gas.

  10. METHOD FOR TESTING COATINGS

    DOEpatents

    Johns, I.B.; Newton, A.S.

    1958-09-01

    A method is described for detecting pin hole imperfections in coatings on uranium-metal objects. Such coated objects are contacted with a heated atmosphere of gaseous hydrogen and imperfections present in the coatings will allow the uranlum to react with the hydrogen to form uranium hydride. Since uranium hydride is less dense than uranium metal it will swell, causing enlargement of the coating defeot and rendering it visible.