Ab initio investigations of the perovskite and K2NiF4 phases in the Cs-Ca-H system

Solid State Sciences

Volumn 13, Issue 3, 2011, Pages 569-573

  Matar, S F ^a   Nakhl, M ^b   Al Alam, A F ^c   Zakhour, M ^b   Ouaini, N ^c  

^a UNIVERSITÉ DE BORDEAUX   (France)

^b LEBANESE UNIVERSITY   (Lebanon)

^c HOLY SPIRIT UNIVERSITY OF KASLIK USEK   (Lebanon)

Author keywords

ASW; Cs Ca H system; DFT; Ionic hydrides; PAW GGA; VASP

Indexed keywords

ASW; CS-CA-H SYSTEM; DFT; IONIC HYDRIDES; PAW-GGA; VASP;

CALCIUM; CHEMICAL ANALYSIS; CHEMICAL BONDS; EQUATIONS OF STATE; HYDRIDES; PEROVSKITE;

CESIUM;

EID: 79952038871     PISSN: 12932558     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.solidstatesciences.2010.12.027     Document Type: Article

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