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Utility of the Nudged Elastic Band Method in Identifying the Minimum Energy Path of an Elementary Organometallic Reaction Step
McPherson, Kate E., Bartolotti, Libero J., Morehead, Andrew T., Sargent, Andrew L.Language:
english
Journal:
Organometallics
DOI:
10.1021/acs.organomet.6b00236
Date:
May, 2016
File:
PDF, 1.55 MB
english, 2016