A density-functional theory investigation of the electronic structure of the active carbon graphite-like and amorphous domains
作者： Oleksiy V. Khavryuchenko , Volodymyr D. Khavryuchenko , Vladyslav V. Lisnyak , Gilles H. Peslherbe
DOI: 10.1016/J.CPLETT.2011.08.009
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摘要: … in its amorphous character. The traditional approach to investigate periodic solids can hardly be used for completely amorphous … of atomic configurations in the amorphous material [16]. …
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