Why Conventional Design Rules for C–H Activation Fail for Open-Shell Transition-Metal Catalysts
Author(s) -
Aditya Nandy,
Heather J. Kulik
Publication year - 2020
Publication title -
acs catalysis
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 4.898
H-Index - 198
ISSN - 2155-5435
DOI - 10.1021/acscatal.0c04300
Subject(s) - catalysis , chemistry , transition metal , spin states , density functional theory , transition state , rational design , reactivity (psychology) , combinatorial chemistry , methanol , oxidation state , chemical physics , computational chemistry , nanotechnology , materials science , inorganic chemistry , organic chemistry , alternative medicine , pathology , medicine
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