DOI: 10.1016/s0022-3697(99)00226-7. Ab initio studies of phonons in MgO by the direct method including LO mode

Ab initio studies of phonons in MgO by the direct method including LO mode

10.1016/s0022-3697(99)00226-7

Crossref journal-article

Elsevier BV

Journal of Physics and Chemistry of Solids (78)

Bibliography

Parlinski, K., ÅaÅ¼ewski, J., & Kawazoe, Y. (2000). Ab initio studies of phonons in MgO by the direct method including LO mode. Journal of Physics and Chemistry of Solids, 61(1), 87â90.

Authors 3

K. Parlinski (first)
J. Łażewski (additional)
Y. Kawazoe (additional)

References 18 Referenced 55

10.1103/PhysRevLett.58.1861 / Phys. Rev. Lett. / Green's-function approach to linear response in solids by Baroni (1987)
10.1103/PhysRevB.34.7146 / Phys. Rev. B / Self-consistent theory of electronic states and dielectric response in semiconductors by Resta (1986)
10.1103/PhysRevB.28.7384 / Phys. Rev. B / First-principle calculation of the dielectric properties of GaAs: dielectric constant, effective charges, and piezoelectric constant by Kitterick (1983)
{'key': '10.1016/S0022-3697(99)00226-7_BIB4', 'first-page': '1222', 'article-title': 'Hartree–Fock approach to macroscopic polarization: dielectric constant and dynamical charges of KNbO3', 'volume': '58', 'author': 'Fu', 'year': '1998', 'journal-title': 'Phys. Rev. B'} / Phys. Rev. B / Hartree–Fock approach to macroscopic polarization: dielectric constant and dynamical charges of KNbO3 by Fu (1998)
K. Parlinski, Calculation of phonon dispersion curves by the direct method, American Institute of Physics, in press. (10.1063/1.59457)
10.1088/0370-1328/90/3/312 / Proc. Phys. Soc. / The phonon dispersion relation for magnesium oxide by Peckham (1967)
10.1088/0022-3719/3/5/017 / J. Phys. C / Lattice dynamics of magnesium oxide by Sangster (1970)
10.1103/PhysRevB.53.14917 / Phys. Rev. B / Nonlocal charge-transfer effects in the lattice dynamics of classical ionic crystals by Falter (1996)
10.1103/PhysRevB.50.3746 / Phys. Rev. B / Ab initio lattice dynamics and charge fluctuations in alkaline-earth oxides by Schutt (1994)
10.1103/RevModPhys.64.1045 / Rev. Mod. Phys. / Iterative minimization techniques for ab initio total-energy calculations: molecular dynamics and conjugate gradients by Payne (1992)
Castep, Molecular Simulations Software, 1998.
{'key': '10.1016/S0022-3697(99)00226-7_BIB12', 'series-title': 'Zahlenwerte und Funktionen aus Naturwissenschaften und Technik', 'volume': '17', 'year': '1982'} / Zahlenwerte und Funktionen aus Naturwissenschaften und Technik (1982)
K. Parlinski, Phonon Software, 1999. (10.1063/1.59457)
10.1103/PhysRev.146.526 / Phys. Rev. / Temperature dependence of infrared dispersion in ionic crystals LiF and MgO by Jasperse (1966)
10.1103/PhysRevB.1.910 / Phys. Rev. B / Microscopic theory of force constants in the adiabatic approximation by Pick (1970)
{'key': '10.1016/S0022-3697(99)00226-7_BIB16', 'first-page': '3', 'article-title': 'Elements of the theory of lattice dynamics', 'volume': '1', 'author': 'Maradudin', 'year': '1974'} / Elements of the theory of lattice dynamics by Maradudin (1974)
10.1103/PhysRevLett.80.1800 / Phys. Rev. Lett. / Quantum-mechanical position operator in extended systems by Resta (1998)
10.1103/PhysRevB.58.1222 / Phys. Rev. B / Macroscopic polarization as a discrete Berry phase of the Hartree–Fock wave function: the single-point limit by Yaschenko (1998)

Dates

Type	When
Created	23 years, 1 month ago (July 25, 2002, 8:47 a.m.)
Deposited	6 years, 3 months ago (April 30, 2019, 2:57 a.m.)
Indexed	1 year, 6 months ago (Feb. 11, 2024, 3:17 a.m.)
Issued	25 years, 7 months ago (Jan. 1, 2000)
Published	25 years, 7 months ago (Jan. 1, 2000)
Published Print	25 years, 7 months ago (Jan. 1, 2000)

Funders 0

None

BibTeX

@article{Parlinski_2000, title={Ab initio studies of phonons in MgO by the direct method including LO mode}, volume={61}, ISSN={0022-3697}, url={http://dx.doi.org/10.1016/s0022-3697(99)00226-7}, DOI={10.1016/s0022-3697(99)00226-7}, number={1}, journal={Journal of Physics and Chemistry of Solids}, publisher={Elsevier BV}, author={Parlinski, K. and Łażewski, J. and Kawazoe, Y.}, year={2000}, month=jan, pages={87–90} }

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