Quantum Chemical Study of the Interligand Electron Transfer in Ru Polypyridyl Complexes

Gerard Alcover-Fortuny; Jianfang Wu; Rosa Caballol; Coen de Graaf

doi:10.1021/acs.jpca.7b11422

Quantum Chemical Study of the Interligand Electron Transfer in Ru Polypyridyl Complexes

The Journal of Physical Chemistry A ◽

10.1021/acs.jpca.7b11422 ◽

2018 ◽

Vol 122 (4) ◽

pp. 1114-1123 ◽

Cited By ~ 6

Author(s):

Gerard Alcover-Fortuny ◽

Jianfang Wu ◽

Rosa Caballol ◽

Coen de Graaf

Keyword(s):

Electron Transfer ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study ◽

Polypyridyl Complexes

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A quantum chemical study of the mechanism for proton-coupled electron transfer leading to proton pumping in cytochrome c oxidase

Molecular Physics ◽

10.1080/00268976.2010.523017 ◽

2010 ◽

Vol 108 (19-20) ◽

pp. 2733-2743 ◽

Cited By ~ 11

Author(s):

Margareta R.A. Blomberg ◽

Per E.M. Siegbahn

Keyword(s):

Electron Transfer ◽

Cytochrome C ◽

Cytochrome C Oxidase ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study ◽

Proton Pumping ◽

Proton Coupled Electron Transfer

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International Journal of Quantum Chemistry ◽

10.1002/(sici)1097-461x(2000)77:1<128::aid-qua12>3.0.co;2-z ◽

2000 ◽

Vol 77 (1) ◽

pp. 128-138 ◽

Cited By ~ 3

Author(s):

Janusz Rak ◽

Alexander A. Voityuk ◽

Notker R�sch

Keyword(s):

Electron Transfer ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study

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Quantum Chemical Study on the Multi-Electron Transfer of Keggin-Type Polyoxotungstate Anions: The Relation of Redox Potentials to the Bond Valence of µ4-O-W

Journal of Computer Chemistry Japan ◽

10.2477/jccj.2017-0029 ◽

2017 ◽

Vol 16 (4) ◽

pp. 93-95

Author(s):

Aki TAKAZAKI ◽

Kazuo EDA ◽

Toshiyuki OSAKAI ◽

Takahito NAKAJIMA

Keyword(s):

Electron Transfer ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study ◽

Bond Valence ◽

Redox Potentials ◽

Keggin Type

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Singlet-State Electron Transfer between a Porphyrin and Ubiquinone: A Transient Resonance Raman and Quantum Chemical Study

The Journal of Physical Chemistry B ◽

10.1021/jp990332u ◽

1999 ◽

Vol 103 (11) ◽

pp. 2034-2034

Author(s):

Tione Buranda ◽

Mark Enlow ◽

Jack Griener ◽

Neil Soice ◽

Mark Ondrias

Keyword(s):

Electron Transfer ◽

Quantum Chemical ◽

Singlet State ◽

Resonance Raman ◽

Quantum Chemical Study ◽

Chemical Study ◽

State Electron ◽

Transient Resonance

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Quantum-Chemical Study of the Electron Transfer in CaTiF6+12CaCl2 Model System

ECS Transactions ◽

10.1149/09810.0463ecst ◽

2020 ◽

Vol 98 (10) ◽

pp. 463-470

Author(s):

Yuriy V. Stulov ◽

Vyacheslav G. Kremenetsky ◽

Sergey A. Kuznetsov

Keyword(s):

Electron Transfer ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study ◽

Model System

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Quantum-Chemical Study of the Electron Transfer in CaTiF6+12CaCl2 Model System

ECS Meeting Abstracts ◽

10.1149/ma2020-02592985mtgabs ◽

2020 ◽

Vol MA2020-02 (59) ◽

pp. 2985-2985

Author(s):

Yuriy V. Stuliov ◽

Vyacheslav G. Kremenetsky ◽

Sergey A. Kuznetsov

Keyword(s):

Electron Transfer ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study ◽

Model System

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Ab initio and post-ab initio quantum chemical study of the heme spin states in electron transfer reactions

Chemical Physics Letters ◽

10.1016/j.cplett.2005.12.067 ◽

2006 ◽

Vol 420 (4-6) ◽

pp. 281-285 ◽

Cited By ~ 5

Author(s):

Tatiana A. Romanova ◽

Pavel O. Krasnov

Keyword(s):

Electron Transfer ◽

Ab Initio ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study ◽

Transfer Reactions ◽

Spin States ◽

Electron Transfer Reactions

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Electron transfer in complexes of BIIcations with organic π-acceptors: a combined experimental and quantum-chemical study

Dalton Transactions ◽

10.1039/c9dt03151k ◽

2019 ◽

Vol 48 (38) ◽

pp. 14354-14366 ◽

Cited By ~ 1

Author(s):

Daniel Vogler ◽

Nina Wolf ◽

Elisabeth Kaifer ◽

Hans-Jörg Himmel

Keyword(s):

Electron Transfer ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study ◽

Redox Potentials

The complexation and reduction of a series of diones with different redox-potentials in a dicationic diborane are analysed.

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On the Possibility of Uphill Intramolecular Electron Transfer in Multicopper Oxidases: Electrochemical and Quantum Chemical Study of Bilirubin Oxidase

Electroanalysis ◽

10.1002/elan.201200188 ◽

2012 ◽

Vol 24 (7) ◽

pp. 1524-1540 ◽

Cited By ~ 42

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Sergey Shleev ◽

Viktor Andoralov ◽

Magnus Falk ◽

Curt T. Reimann ◽

Tautgirdas Ruzgas ◽

...

Keyword(s):

Electron Transfer ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study ◽

Intramolecular Electron Transfer ◽

Multicopper Oxidases ◽

Bilirubin Oxidase

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Quantum Chemical Study of the Electron-Transfer-Catalyzed Splitting of Oxetane and Azetidine Intermediates Proposed in the Photoenzymatic Repair of (6−4) Photoproducts of DNA

Journal of the American Chemical Society ◽

10.1021/ja992244t ◽

2000 ◽

Vol 122 (23) ◽

pp. 5510-5519 ◽

Cited By ~ 34

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Yinsheng Wang ◽

Peter P. Gaspar ◽

John-Stephen Taylor

Keyword(s):

Electron Transfer ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study

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