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Elucidation of Aqueous Solvent-Mediated Hydrogen-Transfer Reactions by ab Initio Molecular Dynamics and Nudged Elastic-Band Studies of NaBH 4 Hydrolysis
Li, Ping, Henkelman, Graeme, Keith, John A., Johnson, J. KarlVolume:
118
Language:
english
Journal:
The Journal of Physical Chemistry C
DOI:
10.1021/jp507872d
Date:
September, 2014
File:
PDF, 6.01 MB
english, 2014