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Sampling Phase Space by a Combined QM/MM ab Initio Car−Parrinello Molecular Dynamics Method with Different (Multiple) Time Steps in the Quantum Mechanical (QM) and Molecular Mechanical (MM) Domains

✍ Scribed by Woo, Tom K.; Margl, Peter; Blöchl, Peter E.; Ziegler, Tom


Book ID
125974235
Publisher
American Chemical Society
Year
2002
Tongue
English
Weight
182 KB
Volume
106
Category
Article
ISSN
1089-5639

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