Browsing Institute of Nano Electronic Engineering (INEE) (Articles) by Subject "Chemical bonding"
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Structural, elastic, electronic, chemical bonding and optical properties of Cu-based oxides ACuO (A = Li, Na, K and Rb): An ab initio study
(Elsevier, 2014-01)Ab initio total energy calculations were performed to study in details the structural, elastic, electronic, chemical bonding and optical properties of Cu-based ternary oxides ACuO (A = Li, Na, K and Rb). Optimized atomic ...