Related references
Note: Only part of the references are listed.Quantum mechanical continuum solvation models
J Tomasi et al.
CHEMICAL REVIEWS (2005)
Smooth solvation method for d-orbital semiempirical calculations of biological reactions. 1. Implementation
J Khandogin et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
A tessellationless integration grid for the polarizable continuum model reaction field
CS Pomelli
JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)
Improving the efficiency and convergence of geometry optimization with the polarizable continuum model: New energy gradients and molecular surface tessellation
H Li et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)
Energies, structures, and electronic properties of molecules in solution with the C-PCM solvation model
M Cossi et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2003)
Continuum solvation of large molecules described by QM/MM: a semi-iterative implementation of the PCM/EFP interface
H Li et al.
THEORETICAL CHEMISTRY ACCOUNTS (2003)
Ab initio molecular dynamics with a continuum solvation model
HM Senn et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
New developments in the polarizable continuum model for quantum mechanical and classical calculations on molecules in solution
M Cossi et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Implementation of solvent reaction fields for electronic structure
DM Chipman et al.
THEORETICAL CHEMISTRY ACCOUNTS (2002)
Identification of deadwood in configuration spaces through general direct configuration interaction
J Ivanic et al.
THEORETICAL CHEMISTRY ACCOUNTS (2001)
An improved iterative solution to solve the electrostatic problem in the polarizable continuum model
CS Pomelli et al.
THEORETICAL CHEMISTRY ACCOUNTS (2001)