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A Combined Car−Parrinello QM/MM Implementation for ab Initio Molecular Dynamics Simulations of Extended Systems: Application to Transition Metal Catalysis

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


Book ID
120416066
Publisher
American Chemical Society
Year
1997
Tongue
English
Weight
224 KB
Volume
101
Category
Article
ISSN
0022-3654

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