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Results: 1-13 |
Results: 13
Ab initio calculations of adiabatic and diabatic potential energy surfacesof Cl(P-2)center dot HCl((1)Sigma(+)) van der Waals complex
Authors: Klos, JA Chalasinski, G Szczsniak, MM Werner, HJ
Citation: Ja. Klos et al., Ab initio calculations of adiabatic and diabatic potential energy surfacesof Cl(P-2)center dot HCl((1)Sigma(+)) van der Waals complex, J CHEM PHYS, 115(7), 2001, pp. 3085-3098
Collision and transport properties of Rg+Cl(P-2) and Rg+Cl-(S-1) (Rg=Ar, Kr) from ab initio potentials
Authors: Buchachenko, AA Krems, RV Szczesniak, MM Xiao, YD Viehland, LA Chalasinski, G
Citation: Aa. Buchachenko et al., Collision and transport properties of Rg+Cl(P-2) and Rg+Cl-(S-1) (Rg=Ar, Kr) from ab initio potentials, J CHEM PHYS, 114(22), 2001, pp. 9919-9928
Ab initio zero electron kinetic energy spectroscopy of the ArCl- and KrCl-anions
Authors: Buchachenko, AA Szczesniak, MM Chalasinski, G
Citation: Aa. Buchachenko et al., Ab initio zero electron kinetic energy spectroscopy of the ArCl- and KrCl-anions, J CHEM PHYS, 114(22), 2001, pp. 9929-9937
Theoretical prediction of the ArO- anion ZEKE photoelectron spectrum
Authors: Buchachenko, AA Szczesniak, MM Chalasinski, G
Citation: Aa. Buchachenko et al., Theoretical prediction of the ArO- anion ZEKE photoelectron spectrum, CHEM P LETT, 347(4-6), 2001, pp. 415-420
Ab initio potential-energy surface for the He(S-1) plus NO(X (2)Pi) interaction and bound rovibrational states
Authors: Klos, J Chalasinski, G Berry, MT Bukowski, R Cybulski, SM
Citation: J. Klos et al., Ab initio potential-energy surface for the He(S-1) plus NO(X (2)Pi) interaction and bound rovibrational states, J CHEM PHYS, 112(5), 2000, pp. 2195-2203
Structure and energetics of ArnNO- clusters from ab initio calculations
Authors: Jakowski, J Klos, J Chalasinski, G Severson, MW Szczesniak, MM Cybulski, SM
Citation: J. Jakowski et al., Structure and energetics of ArnNO- clusters from ab initio calculations, J CHEM PHYS, 112(24), 2000, pp. 10895-10904
Ab initio based study of the ArO- photoelectron spectra: Selectivity of spin-orbit transitions
Authors: Buchachenko, AA Jakowski, J Chalasinski, G Szczesniak, MM Cybulski, SM
Citation: Aa. Buchachenko et al., Ab initio based study of the ArO- photoelectron spectra: Selectivity of spin-orbit transitions, J CHEM PHYS, 112(13), 2000, pp. 5852-5865
Ab initio potential energy surface for the Ar(S-1) plus OH(X-2 Pi) interaction and bound rovibrational states
Authors: Klos, J Chalasinski, G Berry, MT Kendall, RA Burcl, R Szczesniak, MM Cybulski, SM
Citation: J. Klos et al., Ab initio potential energy surface for the Ar(S-1) plus OH(X-2 Pi) interaction and bound rovibrational states, J CHEM PHYS, 112(11), 2000, pp. 4952-4958
State of the art and challenges of the ab initio theory of intermolecular interactions
Authors: Chalasinski, G Szczesniak, MM
Citation: G. Chalasinski et Mm. Szczesniak, State of the art and challenges of the ab initio theory of intermolecular interactions, CHEM REV, 100(11), 2000, pp. 4227-4252
A three-dimensional potential energy surface for He+Cl-2 (B (3)Pi(0u+)): Ab initio calculations and a multiproperty fit
Authors: Williams, J Rohrbacher, A Seong, J Marianayagam, N Janda, KC Burcl, R Szczesniak, MM Chalasinski, G Cybulski, SM Halberstadt, N
Citation: J. Williams et al., A three-dimensional potential energy surface for He+Cl-2 (B (3)Pi(0u+)): Ab initio calculations and a multiproperty fit, J CHEM PHYS, 111(3), 1999, pp. 997-1007
An ab initio study of the Ar-HCN complex
Authors: Cybulski, SM Couvillion, J Klos, J Chalasinski, G
Citation: Sm. Cybulski et al., An ab initio study of the Ar-HCN complex, J CHEM PHYS, 110(3), 1999, pp. 1416-1423
The nature of Van der Waals bond
Authors: Chalasinski, G Szczesniak, MM Cybulski, SM
Citation: G. Chalasinski et al., The nature of Van der Waals bond, TH COMP CHE, 6, 1999, pp. 665-699
Many-body exchange effects in clusters of rare gases with a chromophore: He2CO2
Authors: Jakowski, J Chalasinski, G Szczesniak, MM Cybulski, SM
Citation: J. Jakowski et al., Many-body exchange effects in clusters of rare gases with a chromophore: He2CO2, CHEM PHYS, 239(1-3), 1998, pp. 573-591
Risultati: 1-13 |