화학공학소재연구정보센터
검색결과 : 11건
No. Article
1 Exact solution for the hydrogen atom confined by a dielectric continuum and the correct basis set to study many-electron atoms under similar confinements
Martinez-Sanchez MA, Aquino N, Vargas R, Garza J
Chemical Physics Letters, 690, 14, 2017
2 The dielectric continuum solvent model adapted for treating preferential solvation effects
Basilevsky MV, Odinokov AV, Nikitina EA, Petrov NC
Journal of Electroanalytical Chemistry, 660(2), 339, 2011
3 The hydration number of Na+ in liquid water
Rempe SB, Pratt LR
Fluid Phase Equilibria, 183-184, 121, 2001
4 Reaction field treatment of charge penetration
Chipman DM
Journal of Chemical Physics, 112(13), 5558, 2000
5 Dissociation of water at the MgO(100)-water interface: Comparison of theory with experiment
Johnson MA, Stefanovich EV, Truong TN, Gunster J, Goodman DW
Journal of Physical Chemistry B, 103(17), 3391, 1999
6 Ab initio study of the stabilization of multiply charged anions in water
Stefanovich EV, Boldyrev AI, Truong TN, Simons J
Journal of Physical Chemistry B, 102(21), 4205, 1998
7 Theoretical studies of solid-liquid interfaces : Molecular interactions at the MgO(001)-water interface
Johnson MA, Stefanovich EV, Truong TN
Journal of Physical Chemistry B, 102(33), 6391, 1998
8 A General Methodology for Quantum Modeling of Free-Energy Profile of Reactions in Solution - An Application to the Menshutkin Nh3+ch3Cl Reaction in Water
Truong TN, Truong TT, Stefanovich EV
Journal of Chemical Physics, 107(6), 1881, 1997
9 Stokes Shift as a Tool for Probing the Solvent Reorganization Energy
Mertz EL, Tikhomirov VA, Krishtalik LI
Journal of Physical Chemistry A, 101(19), 3433, 1997
10 (1,2)-Acyloxy Shifts in Radicals - A Computational Investigation of Substituent and Solvent Effects
Zipse H
Journal of the American Chemical Society, 119(5), 1087, 1997