Christopher J. Cramer
Christopher J. Cramer
Verified email at umn.edu - Homepage
Title
Cited by
Cited by
Year
Universal solvation model based on solute electron density and on a continuum model of the solvent defined by the bulk dielectric constant and atomic surface tensions
AV Marenich, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry B 113 (18), 6378-6396, 2009
78062009
Essentials of computational chemistry: theories and models
CJ Cramer
John Wiley & Sons, 2013
48582013
Implicit solvation models: equilibria, structure, spectra, and dynamics
CJ Cramer, DG Truhlar
Chemical Reviews 99 (8), 2161-2200, 1999
24671999
Advances in molecular quantum chemistry contained in the Q-Chem 4 program package
Y Shao, Z Gan, E Epifanovsky, ATB Gilbert, M Wormit, J Kussmann, ...
Molecular Physics 113 (2), 184-215, 2015
17672015
Density functional theory for transition metals and transition metal chemistry
CJ Cramer, DG Truhlar
Physical Chemistry Chemical Physics 11 (46), 10757-10816, 2009
13992009
Consistent van der Waals radii for the whole main group
M Mantina, AC Chamberlin, R Valero, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry A 113 (19), 5806-5812, 2009
9032009
Parametrized models of aqueous free energies of solvation based on pairwise descreening of solute atomic charges from a dielectric medium
GD Hawkins, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry 100 (51), 19824-19839, 1996
9021996
Aqueous solvation free energies of ions and ion− water clusters based on an accurate value for the absolute aqueous solvation free energy of the proton
CP Kelly, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry B 110 (32), 16066-16081, 2006
8082006
Pairwise solute descreening of solute charges from a dielectric medium
GD Hawkins, CJ Cramer, DG Truhlar
Chemical Physics Letters 246 (1-2), 122-129, 1995
7211995
Use of solution-phase vibrational frequencies in continuum models for the free energy of solvation
RF Ribeiro, AV Marenich, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry B 115 (49), 14556-14562, 2011
6042011
General parameterized SCF model for free energies of solvation in aqueous solution
CJ Cramer, DG Truhlar
Journal of the American Chemical Society 113 (22), 8305-8311, 1991
5541991
An SCF solvation model for the hydrophobic effect and absolute free energies of aqueous solvation
CJ Cramer, DG Truhlar
Science 256 (5054), 213-217, 1992
5401992
Destruction of chemical warfare agents using metal–organic frameworks
JE Mondloch, MJ Katz, WC Isley Iii, P Ghosh, P Liao, W Bury, GW Wagner, ...
Nature materials 14 (5), 512-516, 2015
5332015
A universal approach to solvation modeling
CJ Cramer, DG Truhlar
Accounts of chemical research 41 (6), 760-768, 2008
4952008
Model for aqueous solvation based on class IV atomic charges and first solvation shell effects
CC Chambers, GD Hawkins, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry 100 (40), 16385-16398, 1996
4491996
Self-consistent reaction field model for aqueous and nonaqueous solutions based on accurate polarized partial charges
AV Marenich, RM Olson, CP Kelly, CJ Cramer, DG Truhlar
Journal of Chemical Theory and Computation 3 (6), 2011-2033, 2007
4322007
SM6: A density functional theory continuum solvation model for calculating aqueous solvation free energies of neutrals, ions, and solute− water clusters
CP Kelly, CJ Cramer, DG Truhlar
Journal of chemical theory and computation 1 (6), 1133-1152, 2005
4272005
AM1-SM2 and PM3-SM3 parameterized SCF solvation models for free energies in aqueous solution
CJ Cramer, DG Truhlar
Journal of computer-aided molecular design 6 (6), 629-666, 1992
4211992
Adding explicit solvent molecules to continuum solvent calculations for the calculation of aqueous acid dissociation constants
CP Kelly, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry A 110 (7), 2493-2499, 2006
4062006
Single-ion solvation free energies and the normal hydrogen electrode potential in methanol, acetonitrile, and dimethyl sulfoxide
CP Kelly, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry B 111 (2), 408-422, 2007
4002007
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