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Chemistry - An Asian Journal

Volumn 9, Issue 7, 2014, Pages 1714-1723

The computational road to better catalysts

(2) Jover, Jesús b Fey, Natalie a

a UNIVERSITY OF BRISTOL (United Kingdom)

b UNIVERSITY OF BARCELONA (Spain)

Author keywords

computational chemistry; density functional calculations; homogeneous catalysis; ligand design; reaction mechanisms

Indexed keywords

COMPUTATIONAL CHEMISTRY; DENSITY FUNCTIONAL THEORY; DESIGN FOR TESTABILITY; MECHANICS; ORGANOMETALLICS; REACTION KINETICS; ROADS AND STREETS;

COMPUTATIONAL STUDIES; COMPUTATIONAL TOOLS; HOMOGENEOUS CATALYSIS; LIGAND DESIGN; MECHANISTIC STUDIES; ORGANOMETALLIC CATALYSTS; ORGANOMETALLIC CHEMISTRY; REACTION MECHANISM;

CATALYSTS;

EID: 84903274386 PISSN: 18614728 EISSN: 1861471X Source Type: Journal
DOI: 10.1002/asia.201301696 Document Type: Review

Times cited : (63)

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