期刊
ACTA MATERIALIA
卷 48, 期 1, 页码 71-92出版社
PERGAMON-ELSEVIER SCIENCE LTD
DOI: 10.1016/S1359-6454(99)00288-8
关键词
computational materials science; theory and modelling; electronic and magnetic structure
An overview on methodology and leading-edge applications of atomistic computational materials science based on quantum mechanical concepts is presented. (C) 2000 Acta Metallurgica Inc. Published by Elsevier Science Ltd. All rights reserved.
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