First-principles study on the electronic structure and optical properties of Tl2Cd2(SO4)3 and Rb 2Cd2(SO4)3

Chinese Physics

Volumn 16, Issue 12, 2007, Pages 3798-3802

  Xu, Bin ^a   Cheng, Zheng Ze ^a,b   Yi, Lin ^a   Cheng, Ze ^a  

^a HUAZHONG UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

^b HUBEI UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

Author keywords

Band gap; Electronic structure; Langbeinite; Optical properties

Indexed keywords

CHEMICAL BONDS; ELECTRONIC STRUCTURE; OPTICAL PROPERTIES; PHOTONIC BAND GAP;

FULL-POTENTIAL LINEARIZED AUGMENTED PLANE WAVE (FPLAPW) METHODS; OXYGEN ATOMS;

THALLIUM COMPOUNDS;

EID: 37549067716     PISSN: 10091963     EISSN: 17414199     Source Type: Journal    
DOI: 10.1088/1009-1963/16/12/040     Document Type: Article

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