Open AccessA Comparative <em>Ab initio</em> Study of the Geometric and Electronic Structures of B<sub>2</sub>Au<sub>4</sub>, Al<sub>2</sub>Au<sub>4</sub> and BAlAu<sub>4</sub>
Author(s) -
Wenzhi Yao,
ZhangHui Lu,
SiDian Li
Publication year - 2014
Publication title -
wuli huaxue xuebao
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.396
H-Index - 37
ISSN - 1000-6818
DOI - 10.3866/pku.whxb201409301
Subject(s) - ab initio , ab initio quantum chemistry methods , electronic structure , materials science , physics , molecular physics , computational chemistry , condensed matter physics , chemistry , quantum mechanics , molecule