Ab initio molecular dynamics : Basic theory and advanced methods
Ab initio molecular dynamics revolutionized the field of realistic computer simulation of complex molecular systems and processes, including chemical reactions, by unifying molecular dynamics and electronic structure theory. This book provides the first coherent presentation of this rapidly growing...
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| Format: | Llibre |
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Cambridge
Cambridge University Press
2009
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| Thư viện lưu trữ: | Trung tâm Học liệu Trường Đại học Cần Thơ |
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