화학공학소재연구정보센터
검색결과 : 15건
No. Article
1 Description of Chiral Complexes within Functional-Group Symmetry-Adapted Perturbation Theory-The Case of (S/R)-Carvone with Derivatives of (-)-Menthol
Chojecki M, Rutkowska-Zbik D, Korona T
Journal of Physical Chemistry A, 124(38), 7735, 2020
2 Interaction of Boron-Nitrogen Doped Benzene Isomers with Water
Yourdkhani S, Chojecki M, Hapka M, Korona T
Journal of Physical Chemistry A, 120(31), 6287, 2016
3 Structure and Energetics of Complexes of B12N12 with Hydrogen Halides-SAPT(DFT) and MP2 Study
Yourdkhani S, Korona T, Hadipour NL
Journal of Physical Chemistry A, 119(24), 6446, 2015
4 Local treatment of electron excitations in the EOM-CCSD method
Korona T, Werner HJ
Journal of Chemical Physics, 118(7), 3006, 2003
5 Symmetry-forcing procedure and convergence behavior of perturbation expansions for molecular interaction energies
Patkowski K, Jeziorski B, Korona T, Szalewicz K
Journal of Chemical Physics, 117(11), 5124, 2002
6 Theoretical predictions of vibration-rotation-tunneling dynamics of the weakly bound trimer (H2O)(2)HCl
Struniewicz C, Korona T, Moszynski R, Milet A
Chemical Physics Letters, 343(5-6), 588, 2001
7 Convergence behavior of the symmetry-adapted perturbation theory for states submerged in Pauli forbidden continuum
Patkowski K, Korona T, Jeziorski B
Journal of Chemical Physics, 115(3), 1137, 2001
8 Spectroscopic, collisional, and thermodynamic properties of the He-CO2 complex from an ab initio potential: Theoretical predictions and confrontation with the experimental data
Korona T, Moszynski R, Thibault F, Launay JM, Bussery-Honvault B, Boissoles J, Wormer PES
Journal of Chemical Physics, 115(7), 3074, 2001
9 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
10 Infrared spectroscopy and ab initio potential energy surface for Ne-C2H2 and Ne-C2HD complexes
Bemish RJ, Oudejans L, Miller RE, Moszynski R, Heijmen TGA, Korona T, Wormer PES, van der Avoird A
Journal of Chemical Physics, 109(20), 8968, 1998