화학공학소재연구정보센터
검색결과 : 10건
No. Article
1 Extension of an Atom-Atom Dispersion Function to Halogen Bonds and Its Use for Rational Design of Drugs and Biocatalysts
Jedwabny W, Dyguda-Kazimierowicz E, Pernal K, Szalewicz K, Patkowski K
Journal of Physical Chemistry A, 125(8), 1787, 2021
2 Ab Initio Study of Chiral Discrimination in the Glycidol Dimer
Hemmati R, Patkowski K
Journal of Physical Chemistry A, 124(45), 9436, 2020
3 Chiral Self Recognition: Interactions in Propylene Oxide Complexes
Hemmati R, Patkowski K
Journal of Physical Chemistry A, 123(40), 8607, 2019
4 Highly Correlated Electronic Structure Calculations of the He-C-3 van der Waals Complex and Collision-Induced Rotational Transitions of C-3
Smith DGA, Patkowski K, Trinh D, Balakrishnan N, Lee TG, Forrey RC, Yang BH, Stancil PC
Journal of Physical Chemistry A, 118(33), 6351, 2014
5 Interactions in diatomic dimers involving closed-shell metals
Patkowski K, Podeszwa R, Szalewicz K
Journal of Physical Chemistry A, 111(49), 12822, 2007
6 Accurate pair interaction energies for helium from supermolecular gaussian geminal Calculations
Patkowski K, Cencek W, Jeziorska M, Jeziorski B, Szalewicz K
Journal of Physical Chemistry A, 111(31), 7611, 2007
7 Unified treatment of chemical and van der Waals forces via symmetry-adapted perturbation expansion
Patkowski K, Jeziorski B, Szalewicz K
Journal of Chemical Physics, 120(15), 6849, 2004
8 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
9 Elastic and rotationally inelastic differential cross sections for He+H2O collisions
Brudermann J, Steinbach C, Buck U, Patkowski K, Moszynski R
Journal of Chemical Physics, 117(24), 11166, 2002
10 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