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Full Record Details
Persistent URL
http://purl.org/net/epubs/work/38134
Record Status
Checked
Record Id
38134
Title
Optimization of quantum mechanical molecular mechanical partitioning schemes: Gaussian delocalization of molecular mechanical charges and the double link atom method
Contributors
D Das
,
KP Eurenius
,
EM Billings
,
P Sherwood (CCLRC Daresbury Lab.)
,
DC Chatfield
,
M Hodoscek
,
BR Brooks
Abstract
Organisation
CCLRC
,
CSE
,
CSE-CCG
Keywords
Chemistry
Funding Information
Related Research Object(s):
Licence Information:
Language
English (EN)
Type
Details
URI(s)
Local file(s)
Year
Journal Article
J Phys Chem
117 (2002): 10534.
doi:10.1063/1.1520134
2002
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