Theory of local dynamical magnetic susceptibilities from the Korringa-Kohn-Rostoker Green function method

Lounis, S.; Costa, A. T.; Muniz, R. B.; Mills, D. L.

doi:10.1103/PhysRevB.83.035109

Title: Theory of local dynamical magnetic susceptibilities from the Korringa-Kohn-Rostoker Green function method

Full Record
Other Related Research

Authors:: Lounis, S.; Costa, A. T.; Muniz, R. B.; Mills, D. L.

Publication Date:: Thu Jan 13 00:00:00 EST 2011

Sponsoring Org.:: USDOE

OSTI Identifier:: 1101369

Resource Type:: Publisher's Accepted Manuscript

Journal Name:: Physical Review B

Additional Journal Information:: Journal Volume: 83; Journal Issue: 3; Journal ID: ISSN 1098-0121

Publisher:: American Physical Society

Country of Publication:: United States

Language:: English

Citation Formats


                    Lounis, S., Costa, A. T., Muniz, R. B., and Mills, D. L. Theory of local dynamical magnetic susceptibilities from the Korringa-Kohn-Rostoker Green function method.  United States: N. p., 2011. 
Web.  doi:10.1103/PhysRevB.83.035109.

Copy to clipboard


                    Lounis, S., Costa, A. T., Muniz, R. B., & Mills, D. L. Theory of local dynamical magnetic susceptibilities from the Korringa-Kohn-Rostoker Green function method.  United States.  https://doi.org/10.1103/PhysRevB.83.035109

Copy to clipboard


                    Lounis, S., Costa, A. T., Muniz, R. B., and Mills, D. L. Thu .  
"Theory of local dynamical magnetic susceptibilities from the Korringa-Kohn-Rostoker Green function method".  United States.  https://doi.org/10.1103/PhysRevB.83.035109.

Copy to clipboard


                    
@article{osti_1101369,

  title        = {Theory of local dynamical magnetic susceptibilities from the Korringa-Kohn-Rostoker Green function method},

  author       = {Lounis, S. and Costa, A. T. and Muniz, R. B. and Mills, D. L.},

  abstractNote = {},

  doi          = {10.1103/PhysRevB.83.035109},

  journal      = {Physical Review B},

  number       = 3,

  volume       = 83,

  place        = {United States},

  year         = {Thu Jan 13 00:00:00 EST 2011},

  month        = {Thu Jan 13 00:00:00 EST 2011}

}

Copy to clipboard

Journal Article:

Free Publicly Available Full Text

Accepted Manuscript (Publisher)

Publisher's Version of Record
https://doi.org/10.1103/PhysRevB.83.035109

Other availability

Search WorldCat to find libraries that may hold this journal

Citation Metrics:

Cited by: 41 works

Citation information provided by
Web of Science

Save / Share:

Export Metadata

Save to My Library

Similar Records in DOE PAGES and OSTI.GOV collections:

Treatment of lattice relaxations in dilute alloys within the Korringa-Kohn-Rostoker Green's-function method

Journal Article Stefanou, N ; Braspenning, P J ; Zeller, R ; ... - Phys. Rev. B: Condens. Matter; (United States)

We develop a formalism to take into account the lattice relaxation around an impurity within the Korringa-Kohn-Rostoker Green's-function method. Using this formalism and the density-functional theory in the local spin-density approximation we perform first-principles, self-consistent calculations for the electronic structure of some dilute metallic alloys. In particular, we investigate the influence of lattice relaxations on the local magnetic moments in CuMn, CuFe, CuCo, and NiMn.
https://doi.org/10.1103/PhysRevB.36.6372
High-temperature electronic structure with the Korringa-Kohn-Rostoker Green's function method [High Temperature Electronic Structure with KKR]

Journal Article Starrett, Charles Edward - Physical Review E

Modeling high-temperature (tens or hundreds of eV), dense plasmas is challenging due to the multitude of non-negligible physical effects including significant partial ionization and multisite effects. These effects cause the breakdown or intractability of common methods and approximations used at low temperatures, such as pseudopotentials or plane-wave basis sets. Here we explore the Korringa-Kohn-Rostoker Green's function method at these high-temperature conditions. The method is all electron, does not rely on pseudopotentials, and uses a spherical harmonic basis set, and so avoids the aforementioned limitations. Finally, it is found to be accurate for solid density aluminum and iron plasmas when comparedmore »« less
Cited by 11
https://doi.org/10.1103/PhysRevE.97.053205

Full Text Available
Multiple-scattering theory and the quadratic Korringa-Kohn-Rostoker method

Journal Article Faulkner, J S ; Horvath, E A ; Nicholson, D M - Physical Review, B: Condensed Matter; (United States)

It has been demonstrated that the quadratic Korringa-Kohn-Rostoker method is a fast and reliable technique for band-theory calculations with full self-consistent potential functions. The question addressed here is whether there are approximations to be made in the theory that will provide considerable simplifications in its application without introducing unacceptable errors. Two such approximations are discussed: a perturbative method for dealing with the quadratic terms and a noniterative approximation to the scattering matrices. It will be shown that some of our results are of interest in the more general context of multiple-scattering theory.
https://doi.org/10.1103/PhysRevB.44.8467
Applications of the quadratic Korringa-Kohn-Rostoker band-theory method to complex lattices

Journal Article Wang, Y ; Faulkner, J S ; Nicholson, D M - Physical Review, B: Condensed Matter; (United States)

The quadratic Korringa-Kohn-Rostoker band-theory method is generalized to treat crystals with many atoms per unit cell. It is applied to palladium hydride with the NaCl structure and a test case in which two niobium atoms are placed on the sites of a CsCl lattice. We demonstrate that this is a fast and reliable band-theory method for compounds.
https://doi.org/10.1103/PhysRevB.45.1425
Applications of the quadratic Korringa-Kohn-Rostoker band-theory method

Journal Article Nicholson, D M ; Faulkner, J S - Phys. Rev. B: Condens. Matter; (United States)

Comparisons with other calculations in the literature are used to demonstrate that the quadratic Korringa-Kohn-Rostoker band-theory method gives excellent eigenvalues for full self-consistent potentials with no shape approximation. The equations for the Green function are reformulated, thus eliminating a problem that had hampered calculations of self-consistent potentials and total energies with the use of this method.
https://doi.org/10.1103/PhysRevB.39.8187

Similar Records