Structure and Lattice Dynamics of MF 2 (M = Ca, Sr, Ba, Pb) in Cubic and Orthorhombic Phases: The ab initio Calculations

Research output: Contribution to journalArticleResearchpeer-review

Original languageEnglish
Pages (from-to)11-22
Number of pages12
JournalPhysics of the Solid State
Volume61
Issue number1
DOIs
Publication statusPublished - 1 Jan 2019

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Lattice vibrations
Crystals
Fluorspar
Periodic structures
fluorite
Elastic constants
Discrete Fourier transforms
functionals
crystals
Raman scattering
elastic properties
Crystal structure
Phase transitions
Raman spectra
formalism
vibration
crystal structure
simulation

Keywords

  • X-RAY-DIFFRACTION
  • ELECTRONIC-STRUCTURE
  • ELASTIC-CONSTANTS
  • HIGH-PRESSURE
  • DIELECTRIC-PROPERTIES
  • NEUTRON-SCATTERING
  • SPECTRA
  • FLUORIDE
  • ANHARMONICITY
  • TRANSITION

ASJC Scopus subject areas

  • Electronic, Optical and Magnetic Materials
  • Condensed Matter Physics

WoS ResearchAreas Categories

  • Physics, Condensed Matter

GRNTI

  • 29.00.00 PHYSICS

Level of Research Output

  • VAK List

Cite this

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title = "Structure and Lattice Dynamics of MF 2 (M = Ca, Sr, Ba, Pb) in Cubic and Orthorhombic Phases: The ab initio Calculations",
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author = "Chernyshev, {V. A.} and Ryumshin, {V. S.} and Agzamova, {P. A.}",
year = "2019",
month = "1",
day = "1",
doi = "10.1134/S1063783419010062",
language = "English",
volume = "61",
pages = "11--22",
journal = "Physics of the Solid State",
issn = "1063-7834",
publisher = "American Institute of Physics Publising LLC",
number = "1",

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Structure and Lattice Dynamics of MF 2 (M = Ca, Sr, Ba, Pb) in Cubic and Orthorhombic Phases: The ab initio Calculations. / Chernyshev, V. A.; Ryumshin, V. S.; Agzamova, P. A.

In: Physics of the Solid State, Vol. 61, No. 1, 01.01.2019, p. 11-22.

Research output: Contribution to journalArticleResearchpeer-review

TY - JOUR

T1 - Structure and Lattice Dynamics of MF 2 (M = Ca, Sr, Ba, Pb) in Cubic and Orthorhombic Phases: The ab initio Calculations

AU - Chernyshev, V. A.

AU - Ryumshin, V. S.

AU - Agzamova, P. A.

PY - 2019/1/1

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KW - DIELECTRIC-PROPERTIES

KW - NEUTRON-SCATTERING

KW - SPECTRA

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KW - ANHARMONICITY

KW - TRANSITION

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DO - 10.1134/S1063783419010062

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JO - Physics of the Solid State

JF - Physics of the Solid State

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