Intermolecular interactions with the direct reaction field method

1990 ◽  
Vol 38 (2) ◽  
pp. 181-189 ◽  
Author(s):  
P. Th. Van Duijnen ◽  
J. A. C. Rullmann
Keyword(s):  
Intermolecular Interactions ◽  
Field Method ◽  
Direct Reaction ◽  
Reaction Field

A multiconfigurational self‐consistent reaction‐field method

1988 ◽  
Vol 89 (5) ◽  
pp. 3086-3095 ◽  
Author(s):  
Kurt V. Mikkelsen ◽  
Hans Ågren ◽  
Hans Jo/rgen Aa. Jensen ◽  
Trygve Helgaker
Keyword(s):  
Field Method ◽  
Reaction Field ◽  
Self Consistent

The iterative self-consistent reaction-field method: The refractive index of pure water

2010 ◽  
Vol 111 (4) ◽  
pp. 904-913 ◽  
Author(s):  
Kristian O. Sylvester-Hvid ◽  
Kurt V. Mikkelsen ◽  
Mark A. Ratner
Keyword(s):  
Refractive Index ◽  
Pure Water ◽  
Field Method ◽  
Reaction Field ◽  
Self Consistent

Solvent Induced Charge Separation in the Excited States of Symmetrical Ethylene:  A Direct Reaction Field Study

2001 ◽  
Vol 105 (14) ◽  
pp. 3583-3590 ◽  
Author(s):  
Robert W. J. Zijlstra ◽  
Ferdinand C. Grozema ◽  
Marcel Swart ◽  
Ben L. Feringa ◽  
Piet Th. van Duijnen
Keyword(s):  
Field Study ◽  
Excited States ◽  
Charge Separation ◽  
Direct Reaction ◽  
Reaction Field ◽  
Induced Charge

Many-body interactions calculated with the direct reaction field model

1999 ◽  
Vol 246 (1-3) ◽  
pp. 217-227 ◽  
Author(s):  
Ferdinand C Grozema ◽  
Robert W.J Zijlstra ◽  
Piet Th van Duijnen
Keyword(s):  
Field Model ◽  
Direct Reaction ◽  
Many Body ◽  
Reaction Field ◽  
Many Body Interactions
Sign in / Sign up

Export Citation Format

Share Document