Symmetry analysis of calculated vibrational spectra of Rb 2KScF6 crystal

Computational Materials Science

Volumn 36, Issue 1-2, 2006, Pages 221-224

  Krylov, A S ^a   Bulou, A ^b   Krylova, S N ^a   Voronov, V N ^a   Vtyurin, A N ^a   Zamkova, N G ^a  

^a KIRENSKY INSTITUTE OF PHYSICS   (Russian Federation)

^b UNIVERSITÉ DU MAINE   (France)

Author keywords

Ab initio simulations; Elpasolites; Lattice dynamics; Phase transition; Rb2KScF6; Soft mode

Indexed keywords

COMPUTER SIMULATION; LATTICE VIBRATIONS; PHASE TRANSITIONS; RUBIDIUM COMPOUNDS; VIBRATIONS (MECHANICAL);

AB INITIO SIMULATIONS; ELPASOLITES; RB2KSCF6; SOFT MODE;

CRYSTALLINE MATERIALS;

EID: 33645024191     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2005.06.002     Document Type: Conference Paper

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