Spin–orbit coupled excited states in transition metal complexes: A configuration interaction treatment of HCo(CO)4

Carl Ribbing; Chantal Daniel

doi:10.1063/1.467068

Spin–orbit coupled excited states in transition metal complexes: A configuration interaction treatment of HCo(CO)4

The Journal of Chemical Physics ◽

10.1063/1.467068 ◽

1994 ◽

Vol 100 (9) ◽

pp. 6591-6596 ◽

Cited By ~ 24

Author(s):

Carl Ribbing ◽

Chantal Daniel

Keyword(s):

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Configuration Interaction ◽

Spin Orbit ◽

Interaction Treatment

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Toward Full Configuration Interaction for Transition-Metal Complexes

The Journal of Physical Chemistry A ◽

10.1021/acs.jpca.0c07624 ◽

2021 ◽

Vol 125 (7) ◽

pp. 1598-1609

Author(s):

Alan E. Rask ◽

Paul M. Zimmerman

Keyword(s):

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Configuration Interaction ◽

Full Configuration Interaction

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Molecular and electronic structure in the metal-to-ligand charge-transfer excited states of d6 transition-metal complexes in solution

Journal of the American Chemical Society ◽

10.1021/ja00324a017 ◽

1984 ◽

Vol 106 (12) ◽

pp. 3492-3500 ◽

Cited By ~ 121

Author(s):

Jonathan V. Caspar ◽

T. David Westmoreland ◽

George H. Allen ◽

Paul G. Bradley ◽

Thomas J. Meyer ◽

...

Keyword(s):

Electronic Structure ◽

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Ligand Charge Transfer ◽

Molecular And Electronic Structure

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Antiferromagnetism in transition metal complexes. III. Ground and low-lying excited states of cupric acetate

Inorganic Chemistry ◽

10.1021/ic50088a020 ◽

1970 ◽

Vol 9 (6) ◽

pp. 1390-1395 ◽

Cited By ~ 25

Author(s):

R. W. Jotham ◽

Sidney F. A. Kettle

Keyword(s):

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Cupric Acetate

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Charge-Transfer Excited States of Transition Metal Complexes

Electron Transfer in Chemistry ◽

10.1002/9783527618248.ch7 ◽

2008 ◽

pp. 238-270 ◽

Cited By ~ 8

Author(s):

John F. Endicott

Keyword(s):

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes

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Quantitative wave function analysis for excited states of transition metal complexes

Coordination Chemistry Reviews ◽

10.1016/j.ccr.2018.01.019 ◽

2018 ◽

Vol 361 ◽

pp. 74-97 ◽

Cited By ~ 47

Author(s):

Sebastian Mai ◽

Felix Plasser ◽

Johann Dorn ◽

Maria Fumanal ◽

Chantal Daniel ◽

...

Keyword(s):

Wave Function ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Function Analysis ◽

Wave Function Analysis

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Spectroscopic investigations of excited states of transition-metal complexes

Accounts of Chemical Research ◽

10.1021/ar50091a003 ◽

1975 ◽

Vol 8 (7) ◽

pp. 231-238 ◽

Cited By ~ 192

Author(s):

Glenn A. Crosby

Keyword(s):

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Spectroscopic Investigations

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ChemInform Abstract: Charge-Transfer Excited States of Transition Metal Complexes

ChemInform ◽

10.1002/chin.200251268 ◽

2010 ◽

Vol 33 (51) ◽

pp. no-no

Author(s):

John F. Endicott

Keyword(s):

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes

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ChemInform Abstract: Proton-Coupled Electron Transfer Originating from Excited States of Luminescent Transition-Metal Complexes.

ChemInform ◽

10.1002/chin.201211231 ◽

2012 ◽

Vol 43 (11) ◽

pp. no-no

Author(s):

Oliver S. Wenger

Keyword(s):

Electron Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Proton Coupled Electron Transfer

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Spin−Orbit Effects on Hyperfine Coupling Tensors in Transition Metal Complexes Using Hybrid Density Functionals and Accurate Spin−Orbit Operators

The Journal of Physical Chemistry A ◽

10.1021/jp049395p ◽

2004 ◽

Vol 108 (23) ◽

pp. 5026-5033 ◽

Cited By ~ 43

Author(s):

Christian Remenyi ◽

Roman Reviakine ◽

Alexei V. Arbuznikov ◽

Juha Vaara ◽

Martin Kaupp

Keyword(s):

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Hyperfine Coupling ◽

Spin Orbit ◽

Density Functionals

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Insights into trans -Ligand and Spin-Orbit Effects on Electronic Structure and Ligand NMR Shifts in Transition-Metal Complexes

Chemistry - A European Journal ◽

10.1002/chem.201700844 ◽

2017 ◽

Vol 23 (41) ◽

pp. 9790-9803 ◽

Cited By ~ 25

Author(s):

Anja H. Greif ◽

Peter Hrobárik ◽

Martin Kaupp

Keyword(s):

Electronic Structure ◽

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Spin Orbit

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