Reorganization Energy for Electron Transfer at Film-Modified Electrode Surfaces: A Dielectric Continuum Model

1994 ◽  
Vol 98 (29) ◽  
pp. 7162-7169 ◽  
Author(s):  
Yi-Ping Liu ◽  
Marshall D. Newton
Keyword(s):  
Electron Transfer ◽  
Modified Electrode ◽  
Continuum Model ◽  
Reorganization Energy ◽  
Electrode Surfaces ◽  
Dielectric Continuum ◽  
Dielectric Continuum Model

How Well Does a Solvated Octa-acid Capsule Shield the Embedded Chromophore? A Computational Analysis Based on an Anisotropic Dielectric Continuum Model

2020 ◽  
Vol 124 (32) ◽  
pp. 6998-7004
Author(s):  
Huseyin Aksu ◽  
Suranjan K. Paul ◽  
John M. Herbert ◽  
Barry D. Dunietz
Keyword(s):  
Continuum Model ◽  
Computational Analysis ◽  
Anisotropic Dielectric ◽  
Octa Acid ◽  
Dielectric Continuum ◽  
Dielectric Continuum Model

Monte Carlo simulation of an inhomogeneous dielectric continuum model for B-DNA

2005 ◽  
Vol 7 (19) ◽  
pp. 3486 ◽  
Author(s):  
Scott Grandison ◽  
Robert Penfold ◽  
Jean-Marc Vanden-Broeck
Keyword(s):  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Continuum Model ◽  
Inhomogeneous Dielectric ◽  
Dielectric Continuum ◽  
Dielectric Continuum Model

A Fast Solver for a Nonlocal Dielectric Continuum Model

2012 ◽  
Vol 34 (2) ◽  
pp. B107-B126 ◽  
Author(s):  
Dexuan Xie ◽  
Yi Jiang ◽  
Peter Brune ◽  
L. Ridgway Scott
Keyword(s):  
Continuum Model ◽  
Fast Solver ◽  
Dielectric Continuum ◽  
Dielectric Continuum Model

A dielectric continuum model of solvation for complex solutes

2005 ◽  
Vol 169 (1-3) ◽  
pp. 69-74 ◽  
Author(s):  
Nicolas Levy ◽  
Daniel Borgis ◽  
Massimo Marchi
Keyword(s):  
Continuum Model ◽  
Dielectric Continuum ◽  
Dielectric Continuum Model

A CC2 dielectric continuum model and a CC2 molecular mechanics model

2003 ◽  
Vol 101 (13) ◽  
pp. 2055-2071 ◽  
Author(s):  
ANDERS OSTED ◽  
JACOB KONGSTED ◽  
KURT MIKKELSEN ◽  
OVE CHRISTIANSEN
Keyword(s):  
Molecular Mechanics ◽  
Continuum Model ◽  
Mechanics Model ◽  
Molecular Mechanics Model ◽  
Dielectric Continuum ◽  
Dielectric Continuum Model

Charge-Dependent Cavity Radii for an Accurate Dielectric Continuum Model of Solvation with Emphasis on Ions: Aqueous Solutes with Oxo, Hydroxo, Amino, Methyl, Chloro, Bromo, and Fluoro Functionalities

2008 ◽  
Vol 112 (42) ◽  
pp. 10604-10613 ◽  
Author(s):  
Bojana Ginovska ◽  
Donald M. Camaioni ◽  
Michel Dupuis ◽  
Christine A. Schwerdtfeger ◽  
Quinn Gil
Keyword(s):  
Continuum Model ◽  
Dielectric Continuum ◽  
Dielectric Continuum Model
Sign in / Sign up

Export Citation Format

Share Document