Browsing School of Materials Engineering (Articles) by Author "Minofar, B."
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Electronic structure, chemical bonding features, and electron charge density of the double-cubane single crystal [Sb7S8 Br 2] (AlCl4)3
Ali Hussain, Reshak, Prof. Dr.; Kamarudin, Hussin, Brig. Jen. Dato' Prof. Dr.; Auluck, S.; Minofar, B.; Kityk, I. V. (American Institute of Physics, 2011-05-16)The present calculations were performed using all-electron full potential linearized augmented plane wave method based on the density functional theory. We have optimized the structure of the double-cubane single crystal ...