화학공학소재연구정보센터
검색결과 : 11건
No. Article
1 Role of cancellation of errors in ab initio calculations: Structure and energetics of the OH- (H2O) system and electric dipole properties of the subsystems (vol 106, pg 12086, 2002)
Weck G, Milet A, Moszynski R, Kochanski E
Journal of Physical Chemistry A, 107(19), 4008, 2003
2 Role of cancellation of errors in ab initio calculations: Structure and energetics of the OH- (H2O) system and electric dipole properties of the subsystems
Weck G, Milet A, Moszynski R, Kochanski E
Journal of Physical Chemistry A, 106(50), 12084, 2002
3 Experimental uptake study of ethanol by water droplets and its theoretical modeling of cluster formation at the interface
Katrib Y, Mirabel P, Le Calve S, Weck G, Kochanski E
Journal of Physical Chemistry B, 106(29), 7237, 2002
4 Interaction of dichloromethane with the coordination sphere of palladium complexes: Toward a first solvation shell model
Visentin T, Kochanski E, Moszynski R, Dedieu A
Journal of Physical Chemistry A, 105(10), 2023, 2001
5 Interaction of dichloromethane with palladium complexes: A comparative symmetry-adapted perturbation theory, supermolecule, and self-consistent reaction field study
Visentin T, Kochanski E, Moszynski R, Dedieu A
Journal of Physical Chemistry A, 105(10), 2031, 2001
6 Anisotropic intermolecular interactions in van der Waals and hydrogen-bonded complexes: What can we get from density functional calculations?
Milet A, Korona T, Moszynski R, Kochanski E
Journal of Chemical Physics, 111(17), 7727, 1999
7 Theoretical study of the OH-(H2O)(2) system : Nature and importance of three-body interactions
Turki N, Milet A, Rahmouni A, Ouamerali O, Moszynski R, Kochanski E, Wormer PES
Journal of Chemical Physics, 109(17), 7157, 1998
8 Casscf/Caspt2 Studies of the Lowest States of H(5)O2(+)
Klein S, Kochanski E, Strich A, Sadlej AJ
Journal of Physical Chemistry A, 101(26), 4799, 1997
9 Theoretical-Studies of H+(H2O)(5)
Corongiu G, Kelterbaum R, Kochanski E
Journal of Physical Chemistry, 99(20), 8038, 1995
10 Behavior and Evolution of the First 28 Protonated Hydrates from Monte-Carlo Studies
Kelterbaum R, Kochanski E
Journal of Physical Chemistry, 99(33), 12493, 1995