Electronic band structures of ATaO3(A = Li, Na, and K) from first-principles many-body perturbation theory

Journal of Physical Chemistry C

Volumn 115, Issue 32, 2011, Pages 16180-16186

  Wang, Huihui ^a   Wu, Feng ^a   Jiang, Hong ^a  

^a PEKING UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

BAND GAPS; ELECTRONIC BAND STRUCTURE; EXPERIMENTAL VALUES; FIRST-PRINCIPLES; GW APPROXIMATION; IDEAL MODEL; IONIC MODELS; MADELUNG POTENTIAL; MANY BODY PERTURBATION THEORY; PHOTOCATALYTIC ACTIVITIES; PHOTOCATALYTIC PROPERTY; RHOMBOHEDRAL STRUCTURES; STRUCTURE DEPENDENCE; THEORETICAL INVESTIGATIONS;

CRYSTAL STRUCTURE; ENERGY GAP; EXPERIMENTS; PHOTOCATALYSIS; SODIUM;

PERTURBATION TECHNIQUES;

EID: 80051744739     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp2047294     Document Type: Article

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