Monte Carlo simulation of the diabatic free energy curves for a dissociative electron transfer reaction in a polar solvent

Journal of Computational Chemistry ◽

10.1002/jcc.540130904 ◽

1992 ◽

Vol 13 (9) ◽

pp. 1057-1065 ◽

Author(s):

Victor Pérez ◽

José M. Lluch ◽

Juan Bertrán

Keyword(s):

Monte Carlo Simulation ◽

Electron Transfer ◽

Monte Carlo ◽

Free Energy ◽

Transfer Reaction ◽

Polar Solvent ◽

Electron Transfer Reaction ◽

Dissociative Electron Transfer

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A Monte Carlo simulation of free energy relationships for the electron transfer reaction between Fe+and Fe2+in water

Journal of Computational Chemistry ◽

10.1002/jcc.540121002 ◽

1991 ◽

Vol 12 (10) ◽

pp. 1165-1171 ◽

Author(s):

Angels González-Lafont ◽

José M. Lluch ◽

Antonio Oliva ◽

Juan Bertrán

Keyword(s):

Monte Carlo Simulation ◽

Electron Transfer ◽

Monte Carlo ◽

Free Energy ◽

Transfer Reaction ◽

Electron Transfer Reaction ◽

Energy Relationships

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Characterization of the free energy dependence of an interprotein electron transfer reaction by variation of pH and site-directed mutagenesis

Biochimica et Biophysica Acta (BBA) - Bioenergetics ◽

10.1016/j.bbabio.2015.06.012 ◽

2015 ◽

Vol 1847 (10) ◽

pp. 1181-1186 ◽

Author(s):

Brian A. Dow ◽

Victor L. Davidson

Keyword(s):

Electron Transfer ◽

Free Energy ◽

Energy Dependence ◽

Transfer Reaction ◽

Electron Transfer Reaction ◽

Site Directed Mutagenesis ◽

Directed Mutagenesis

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Free energy dependence of the electron transfer reaction between methylamine dehydrogenase and amicyanin

Journal of the American Chemical Society ◽

10.1021/ja00103a063 ◽

1994 ◽

Vol 116 (24) ◽

pp. 11201-11202 ◽

Author(s):

Harold B. Brooks ◽

Victor L. Davidson

Keyword(s):

Electron Transfer ◽

Free Energy ◽

Energy Dependence ◽

Transfer Reaction ◽

Electron Transfer Reaction ◽

Methylamine Dehydrogenase

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Experimental investigation of excited-state electron-transfer reaction: effects of free energy and solvent on rates

The Journal of Physical Chemistry ◽

10.1021/j100370a030 ◽

1990 ◽

Vol 94 (7) ◽

pp. 2889-2896 ◽

Author(s):

Jing Ming. Chen ◽

Tong Ing. Ho ◽

Chung Yuan. Mou

Keyword(s):

Experimental Investigation ◽

Electron Transfer ◽

Free Energy ◽

Excited State ◽

Transfer Reaction ◽

Electron Transfer Reaction ◽

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Non-linear effects in the free energy profile of electron transfer reaction: An integral equation approach

Studies in Physical and Theoretical Chemistry - Structure, Fluctuation, and relaxtion in solutions, Proceedings of the Yamada Conference XXXXII ◽

10.1016/s0167-6881(06)80806-2 ◽

1995 ◽

pp. 345-348

Author(s):

Song-Ho Chong ◽

Fumio Hirata

Keyword(s):

Integral Equation ◽

Electron Transfer ◽

Free Energy ◽

Transfer Reaction ◽

Electron Transfer Reaction ◽

Energy Profile ◽

Equation Approach ◽

Free Energy Profile ◽

Integral Equation Approach ◽

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Nonadiabatic chemical reactions in a strong time‐dependent electric field: An electron transfer reaction in a polar solvent

The Journal of Chemical Physics ◽

10.1063/1.467058 ◽

1994 ◽

Vol 100 (9) ◽

pp. 6492-6499 ◽

Author(s):

Yuri Dakhnovskii

Keyword(s):

Electron Transfer ◽

Electric Field ◽

Chemical Reactions ◽

Transfer Reaction ◽

Polar Solvent ◽

Electron Transfer Reaction ◽

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Rigorous calculation of electric field effects on the free energy change of the electron transfer reaction

The Journal of Chemical Physics ◽

10.1063/1.1527632 ◽

2003 ◽

Vol 118 (2) ◽

pp. 669-679 ◽

Author(s):

Kazuhiko Seki ◽

S. D. Traytak ◽

M. Tachiya

Keyword(s):

Electron Transfer ◽

Free Energy ◽

Electric Field ◽

Transfer Reaction ◽

Electron Transfer Reaction ◽

Free Energy Change ◽

Energy Change ◽

Electric Field Effects ◽

Field Effects ◽

Rigorous Calculation

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Theoretical study of a non-adiabatic dissociative electron transfer reaction

Journal of Electroanalytical Chemistry ◽

10.1016/s0022-0728(03)00179-7 ◽

2003 ◽

Vol 554-555 ◽

pp. 201-209 ◽

Author(s):

Anna Ignaczak ◽

Wolfgang Schmickler

Keyword(s):

Electron Transfer ◽

Transfer Reaction ◽

Theoretical Study ◽

Electron Transfer Reaction ◽

Dissociative Electron Transfer

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Monte Carlo study of the dielectric saturation in molecular solutions: physical basis of the C mode in electron-transfer reaction

The Journal of Physical Chemistry ◽

10.1021/j100316a002 ◽

1988 ◽

Vol 92 (5) ◽

pp. 1008-1010 ◽

Author(s):

Yasuyo Hatano ◽

Minoru Saito ◽

Toshiaki Kakitani ◽

Noboru Mataga

Keyword(s):

Electron Transfer ◽

Monte Carlo ◽

Transfer Reaction ◽

Monte Carlo Study ◽

Electron Transfer Reaction ◽

Physical Basis ◽

Dielectric Saturation

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Oxygen transfer by dissociative electron transfer. Reaction of tetranitromethane with diazo compounds and sulfides

Tetrahedron ◽

10.1016/s0040-4020(01)80902-9 ◽

1991 ◽

Vol 47 (23) ◽

pp. 3773-3778 ◽

Author(s):

Waldemar Adam ◽

Elena Gonzalez Nuñez

Keyword(s):

Electron Transfer ◽

Oxygen Transfer ◽

Transfer Reaction ◽

Electron Transfer Reaction ◽

Diazo Compounds ◽

Dissociative Electron Transfer

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