Modeling of charge-transfer transitions and excited states in d6 transition metal complexes by DFT techniques

Coordination Chemistry Reviews ◽

10.1016/j.ccr.2006.05.021 ◽

2007 ◽

Vol 251 (3-4) ◽

pp. 258-287 ◽

Author(s):

Antonín Vlček ◽

Stanislav Záliš

Keyword(s):

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Charge Transfer Transitions

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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 ◽

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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Charge-Transfer Excited States of Transition Metal Complexes

Electron Transfer in Chemistry ◽

10.1002/9783527618248.ch7 ◽

2008 ◽

pp. 238-270 ◽

Author(s):

John F. Endicott

Keyword(s):

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes

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

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: Metal-CO Photodissociation in Transition Metal Complexes: The Role of Ligand-Field and Charge-Transfer Excited States in the Photochemical Dissociation of Metal-Ligand Bonds

10.1002/chin.199912276 ◽

2010 ◽

Vol 30 (12) ◽

pp. no-no

Author(s):

E. J. Baerends ◽

A. Rosa

Keyword(s):

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Ligand Field ◽

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Reactivity of Transition-Metal Complexes in Excited States: C–O Bond Coupling Reductive Elimination of a Ni(II) Complex Is Elicited by the Metal-to-Ligand Charge Transfer State

ACS Catalysis ◽

10.1021/acscatal.9b03827 ◽

2019 ◽

Vol 10 (1) ◽

pp. 1-6 ◽

Author(s):

Pengchen Ma ◽

Shaohong Wang ◽

Hui Chen

Keyword(s):

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Reductive Elimination ◽

Charge Transfer State ◽

Ligand Charge Transfer ◽

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Electroabsorption Spectroscopy of Charge-Transfer States of Transition-Metal Complexes. 2. Metal-to-Ligand and Ligand-to-Metal Charge-Transfer Excited States of Pentaammineruthenium Complexes1

The Journal of Physical Chemistry ◽

10.1021/jp953395v ◽

1996 ◽

Vol 100 (20) ◽

pp. 8157-8169 ◽

Author(s):

Yeung-gyo K. Shin ◽

Bruce S. Brunschwig ◽

Carol Creutz ◽

Norman Sutin

Keyword(s):

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Metal Charge ◽

Electroabsorption Spectroscopy ◽

Metal Charge Transfer

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Excited states of nitrogen, silicon-chelated transition metal complexes: characteristics of .sigma.-bond-to-ligand charge-transfer (SBLCT) excited states in fac-Ir[(6-isopropyl-8-quinolyl)diorganosilyl]3

Inorganic Chemistry ◽

10.1021/ic00074a006 ◽

1993 ◽

Vol 32 (22) ◽

pp. 4681-4682 ◽

Author(s):

Peter I. Djurovich ◽

Richard J. Watts

Keyword(s):

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Ligand Charge Transfer ◽

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ChemInform Abstract: MOLECULAR AND ELECTRONIC STRUCTURE IN THE METAL-TO-LIGAND CHARGE-TRANSFER EXCITED STATES OF D6 TRANSITION-METAL COMPLEXES IN SOLUTION

Chemischer Informationsdienst ◽

10.1002/chin.198438076 ◽

1984 ◽

Vol 15 (38) ◽

Author(s):

J. V. CASPAR ◽

T. D. WESTMORELAND ◽

G. H. ALLEN ◽

P. G. BRADLEY ◽

T. 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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Metal–CO photodissociation in transition metal complexes: The role of ligand-field and charge-transfer excited states in the photochemical dissociation of metal–ligand bonds

Coordination Chemistry Reviews ◽

10.1016/s0010-8545(98)00128-3 ◽

1998 ◽

Vol 177 (1) ◽

pp. 97-125 ◽

Author(s):

E Baerends

Keyword(s):

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Excited States ◽

Transition Metal Complexes ◽

Ligand Field ◽

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Molecular-orbital calculations on transition-metal complexes: Charge-transfer transitions and the interpretation of photoelectron spectra

Chemical Physics Letters ◽

10.1016/0009-2614(71)80438-4 ◽

1971 ◽

Vol 10 (2) ◽

pp. 117-120 ◽

Author(s):

W.Th.A.M. Van Der Lugt

Keyword(s):

Charge Transfer ◽

Transition Metal ◽

Metal Complexes ◽

Molecular Orbital ◽

Transition Metal Complexes ◽

Photoelectron Spectra ◽

Molecular Orbital Calculations ◽

Charge Transfer Transitions

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