Effect of cation substitution on electronic band structure of ZnGeAs 2 pnictides: A mBJLDA approach

Journal of Alloys and Compounds

Volumn 518, Issue , 2012, Pages 74-79

  Saini, Hardev S ^a   Singh, Mukhtiyar ^a   Reshak, Ali H ^b,c   Kashyap, Manish K ^a  

^a KURUKSHETRA UNIVERSITY   (India)

^b UNIVERSITY OF SOUTH BOHEMIA   (Czech Republic)

^c UNIVERSITY MALAYSIA PERLIS   (Malaysia)

Author keywords

Band structure; Chalcopyrite; DFT; FPLAPW method; mBJ

Indexed keywords

BAND GAPS; CATION SUBSTITUTIONS; CHALCOPYRITE; COVALENCIES; DFT; DIRECT BAND GAP; ELECTRONIC BAND STRUCTURE; EXCHANGE AND CORRELATION; FP-LAPW METHOD; FULL POTENTIAL LINEARIZED AUGMENTED PLANE WAVE METHOD; LOCAL ENVIRONMENTS; MBJ; PNICTIDES; REFERENCE COMPOUNDS;

BAND STRUCTURE; COPPER COMPOUNDS; ELECTRONIC PROPERTIES; ENERGY GAP; GERMANIUM; POSITIVE IONS; TIN;

CADMIUM COMPOUNDS;

EID: 84856225031     PISSN: 09258388     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jallcom.2011.12.129     Document Type: Article

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