Density functional study of the electronic structure and lattice dynamics of SrCl2

Journal of Physics Condensed Matter

Volumn 22, Issue 44, 2010, Pages

  Kanchana, V ^a,b   Vaitheeswaran, G ^a,c   Souvatzis, P ^d   Eriksson, O ^d   Lebegue S ^e  

^a ROYAL INSTITUTE OF TECHNOLOGY   (Sweden)

^b INDIAN INSTITUTE OF TECHNOLOGY HYDERABAD   (India)

^c UNIVERSITY OF HYDERABAD   (India)

^d UPPSALA UNIVERSITY   (Sweden)

^e Boulevard des Aiguillettes   (France)

Author keywords

[No Author keywords available]

Indexed keywords

BAND GAPS; DENSITY-FUNCTIONAL STUDY; ELASTIC PROPERTIES; EXCHANGE AND CORRELATION; FIRST-PRINCIPLES CALCULATION; FLUORITE STRUCTURE; GENERALIZED GRADIENT APPROXIMATIONS; GW APPROXIMATION; GW CALCULATIONS; LATTICE DYNAMICAL PROPERTIES; LATTICE DYNAMICS; PHONON DISPERSIONS; THEORETICAL STUDY;

ELASTICITY; ELECTRONIC STRUCTURE; ENERGY GAP; EXPERIMENTS; GROUND STATE; LATTICE VIBRATIONS; SOLIDS;

OPTICAL PROPERTIES;

EID: 78149448081     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/22/44/445402     Document Type: Article

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