Open AccessGeometry and spin-multiplicity of half-sandwich type transition-metal-benzene complexes
Author(s) -
Franck Rabilloud
Publication year - 2005
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.1867434
Subject(s) - complete active space , multiplicity (mathematics) , transition metal , density functional theory , chemistry , electronic structure , ground state , spin states , benzene , multireference configuration interaction , atomic physics , computational chemistry , molecular physics , geometry , physics , basis set , mathematics , organic chemistry , catalysis
Accelerating Research
Robert Robinson Avenue,
Oxford Science Park, Oxford
OX4 4GP, United Kingdom
Address
John Eccles HouseRobert Robinson Avenue,
Oxford Science Park, Oxford
OX4 4GP, United Kingdom