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Results: 1-25 | 26-48
Results: 1-25/48
2ND VIRIAL-COEFFICIENTS FOR ATOM-MOLECULE COMPLEXES FROM AB-INITIO SAPT POTENTIALS
Authors: MOSZYNSKI R KORONA T HEIJMEN TGA WORMER PES VANDERAVOIRD A SCHRAMM B
Citation: R. Moszynski et al., 2ND VIRIAL-COEFFICIENTS FOR ATOM-MOLECULE COMPLEXES FROM AB-INITIO SAPT POTENTIALS, Polish Journal of Chemistry, 72(7), 1998, pp. 1479-1496
DYNAMICS OF CO MOLECULES IN SOLID C-60 AS A FUNCTION OF CAVITY SIZE
Authors: HOLLEMAN I VONHELDEN G VANDERAVOIRD A MEIJER G
Citation: I. Holleman et al., DYNAMICS OF CO MOLECULES IN SOLID C-60 AS A FUNCTION OF CAVITY SIZE, Physical review letters, 80(22), 1998, pp. 4899-4902
INFRARED-SPECTROSCOPY AND AB-INITIO POTENTIAL-ENERGY SURFACE FOR NE-C2H2 AND NE-C2HD COMPLEXES
Authors: BEMISH RJ OUDEJANS L MILLER RE MOSZYNSKI R HEIJMEN TGA KORONA T WORMER PES VANDERAVOIRD A
Citation: Rj. Bemish et al., INFRARED-SPECTROSCOPY AND AB-INITIO POTENTIAL-ENERGY SURFACE FOR NE-C2H2 AND NE-C2HD COMPLEXES, The Journal of chemical physics, 109(20), 1998, pp. 8968-8979
HIGH-RESOLUTION SPECTROSCOPY OF 4-FLUOROSTYRENE-RARE GAS VAN-DER-WAALS COMPLEXES - RESULTS AND COMPARISON WITH THEORETICAL CALCULATIONS
Authors: LAKIN NM PIETRAPERZIA G BECUCCI M CASTELLUCCI E CORENO M GIARDINIGUIDONI A VANDERAVOIRD A
Citation: Nm. Lakin et al., HIGH-RESOLUTION SPECTROSCOPY OF 4-FLUOROSTYRENE-RARE GAS VAN-DER-WAALS COMPLEXES - RESULTS AND COMPARISON WITH THEORETICAL CALCULATIONS, The Journal of chemical physics, 108(5), 1998, pp. 1836-1850
VIBRATIONAL OVERTONES IN THE ELECTRONIC GROUND-STATE OF THE BENZENE-AR COMPLEX - A COMBINED EXPERIMENTAL AND THEORETICAL-ANALYSIS
Authors: NEUHAUSER R BRAUN J NEUSSER HJ VANDERAVOIRD A
Citation: R. Neuhauser et al., VIBRATIONAL OVERTONES IN THE ELECTRONIC GROUND-STATE OF THE BENZENE-AR COMPLEX - A COMBINED EXPERIMENTAL AND THEORETICAL-ANALYSIS, The Journal of chemical physics, 108(20), 1998, pp. 8408-8417
DENSITY-FUNCTIONAL CALCULATIONS OF MOLECULAR HYPERFINE INTERACTIONS IN THE ZERO-ORDER REGULAR APPROXIMATION FOR RELATIVISTIC EFFECTS
Authors: VANLENTHE E VANDERAVOIRD A WORMER PES
Citation: E. Vanlenthe et al., DENSITY-FUNCTIONAL CALCULATIONS OF MOLECULAR HYPERFINE INTERACTIONS IN THE ZERO-ORDER REGULAR APPROXIMATION FOR RELATIVISTIC EFFECTS, The Journal of chemical physics, 108(12), 1998, pp. 4783-4796
TOTAL DIFFERENTIAL CROSS-SECTIONS FOR AR-CH4 FROM AN AB-INITIO POTENTIAL
Authors: HEIJMEN TGA MOSZYNSKI R WORMER PES VANDERAVOIRD A BUCK U STEINBACH C HUTSON JM
Citation: Tga. Heijmen et al., TOTAL DIFFERENTIAL CROSS-SECTIONS FOR AR-CH4 FROM AN AB-INITIO POTENTIAL, The Journal of chemical physics, 108(12), 1998, pp. 4849-4853
ENTRANCE CHANNEL EFFECTS IN THE REACTION OF ALIGNED CA(P-1) WITH HCL
Authors: MEIJER AJHM GROENENBOOM GC VANDERAVOIRD A
Citation: Ajhm. Meijer et al., ENTRANCE CHANNEL EFFECTS IN THE REACTION OF ALIGNED CA(P-1) WITH HCL, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(41), 1997, pp. 7558-7566
AB-INITIO POTENTIAL-ENERGY SURFACE AND INFRARED-SPECTRUM OF THE NE-COCOMPLEX
Authors: MOSZYNSKI R KORONA T WORMER PES VANDERAVOIRD A
Citation: R. Moszynski et al., AB-INITIO POTENTIAL-ENERGY SURFACE AND INFRARED-SPECTRUM OF THE NE-COCOMPLEX, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 101(26), 1997, pp. 4690-4698
ROVIBRATIONAL MOTION OF CO IN SOLID C-60
Authors: HOLLEMAN I VONHELDEN G OLTHOF EHT VANBENTUM PJM ENGELN R NACHTEGAAL GH KENTGENS APM MEIER BH VANDERAVOIRD A MEIJER G
Citation: I. Holleman et al., ROVIBRATIONAL MOTION OF CO IN SOLID C-60, Physical review letters, 79(6), 1997, pp. 1138-1141
DENSITY-FUNCTIONAL CALCULATIONS OF MOLECULAR G-TENSORS IN THE ZERO-ORDER REGULAR APPROXIMATION FOR RELATIVISTIC EFFECTS
Authors: VANLENTHE E WORMER PES VANDERAVOIRD A
Citation: E. Vanlenthe et al., DENSITY-FUNCTIONAL CALCULATIONS OF MOLECULAR G-TENSORS IN THE ZERO-ORDER REGULAR APPROXIMATION FOR RELATIVISTIC EFFECTS, The Journal of chemical physics, 107(7), 1997, pp. 2488-2498
AB-INITIO POTENTIAL-ENERGY SURFACE AND ROTATIONALLY INELASTIC INTEGRAL CROSS-SECTIONS OF THE AR-CH4 COMPLEX
Authors: HEIJMAN TGA KORONA T MOSZYNSKI R WORMER PES VANDERAVOIRD A
Citation: Tga. Heijman et al., AB-INITIO POTENTIAL-ENERGY SURFACE AND ROTATIONALLY INELASTIC INTEGRAL CROSS-SECTIONS OF THE AR-CH4 COMPLEX, The Journal of chemical physics, 107(3), 1997, pp. 902-913
NEW HE-CO INTERACTION ENERGY SURFACE WITH VIBRATIONAL COORDINATE DEPENDENCE .1. AB-INITIO POTENTIAL AND INFRARED-SPECTRUM
Authors: HEIJMEN TGA MOSZYNSKI R WORMER PES VANDERAVOIRD A
Citation: Tga. Heijmen et al., NEW HE-CO INTERACTION ENERGY SURFACE WITH VIBRATIONAL COORDINATE DEPENDENCE .1. AB-INITIO POTENTIAL AND INFRARED-SPECTRUM, The Journal of chemical physics, 107(23), 1997, pp. 9921-9928
SYMMETRY-ADAPTED PERTURBATION-THEORY OF NONADDITIVE 3-BODY INTERACTIONS IN VAN-DER-WAALS-MOLECULES .1. GENERAL-THEORY (VOL 103, PG 8058, 1995)
Authors: MOSZYNSKI R WORMER PES JEZIORSKI B VANDERAVOIRD A
Citation: R. Moszynski et al., SYMMETRY-ADAPTED PERTURBATION-THEORY OF NONADDITIVE 3-BODY INTERACTIONS IN VAN-DER-WAALS-MOLECULES .1. GENERAL-THEORY (VOL 103, PG 8058, 1995), The Journal of chemical physics, 107(2), 1997, pp. 672-673
TOTAL DIFFERENTIAL CROSS-SECTIONS AND DIFFERENTIAL ENERGY-LOSS SPECTRA FOR HE-C2H2 FROM AN AB-INITIO POTENTIAL
Authors: HEIJMAN TGA MOSZYNSKI R WORMER PES VANDERAVOIRD A BUCK U ETTISCHER I KROHNE R
Citation: Tga. Heijman et al., TOTAL DIFFERENTIAL CROSS-SECTIONS AND DIFFERENTIAL ENERGY-LOSS SPECTRA FOR HE-C2H2 FROM AN AB-INITIO POTENTIAL, The Journal of chemical physics, 107(18), 1997, pp. 7260-7265
VIBRATIONAL PREDISSOCIATION OF THE ND3-AR VAN-DER-WAALS COMPLEX - COMPARISON WITH NH3-AR
Authors: MILLAN J HALBERSTADT N VANDERSANDEN G VANDERAVOIRD A
Citation: J. Millan et al., VIBRATIONAL PREDISSOCIATION OF THE ND3-AR VAN-DER-WAALS COMPLEX - COMPARISON WITH NH3-AR, The Journal of chemical physics, 106(22), 1997, pp. 9141-9154
SYMMETRY-ADAPTED PERTURBATION-THEORY APPLIED TO INTERACTION-INDUCED PROPERTIES OF COLLISIONAL COMPLEXES
Authors: HEIJMEN TGA MOSZYNSKI R WORMER PES VANDERAVOIRD A
Citation: Tga. Heijmen et al., SYMMETRY-ADAPTED PERTURBATION-THEORY APPLIED TO INTERACTION-INDUCED PROPERTIES OF COLLISIONAL COMPLEXES, Molecular physics, 89(1), 1996, pp. 81-110
SEMICLASSICAL CALCULATIONS ON THE ENERGY-DEPENDENCE OF THE STERIC EFFECT FOR THE REACTIONS CA(D-1)-]CAX+CH3 WITH X=F, CL, BR(CH(3)X (JKM=111))
Authors: MEIJER AJHM GROENENBOOM GC VANDERAVOIRD A
Citation: Ajhm. Meijer et al., SEMICLASSICAL CALCULATIONS ON THE ENERGY-DEPENDENCE OF THE STERIC EFFECT FOR THE REACTIONS CA(D-1)-]CAX+CH3 WITH X=F, CL, BR(CH(3)X (JKM=111)), Journal of physical chemistry, 100(40), 1996, pp. 16072-16081
DIFFERENTIAL CROSS-SECTIONS FOR ROTATIONAL-EXCITATION OF NH3 BY COLLISIONS WITH AR AND HE - CLOSE-COUPLING RESULTS AND COMPARISON WITH EXPERIMENT
Authors: VANDERSANDEN GCM WORMER PES VANDERAVOIRD A
Citation: Gcm. Vandersanden et al., DIFFERENTIAL CROSS-SECTIONS FOR ROTATIONAL-EXCITATION OF NH3 BY COLLISIONS WITH AR AND HE - CLOSE-COUPLING RESULTS AND COMPARISON WITH EXPERIMENT, The Journal of chemical physics, 105(8), 1996, pp. 3079-3088
SEMICLASSICAL CALCULATIONS ON THE ENERGY-DEPENDENCE OF THE STERIC EFFECT FOR THE REACTION CA(D-1)-]CAF+CH3(CH3F(JKM=111))
Authors: MEIJER AJHM GROENENBOOM GC VANDERAVOIRD A
Citation: Ajhm. Meijer et al., SEMICLASSICAL CALCULATIONS ON THE ENERGY-DEPENDENCE OF THE STERIC EFFECT FOR THE REACTION CA(D-1)-]CAF+CH3(CH3F(JKM=111)), The Journal of chemical physics, 105(6), 1996, pp. 2247-2262
TUNNELING DYNAMICS, SYMMETRY, AND FAR-INFRARED SPECTRUM OF THE ROTATING WATER TRIMER .1. HAMILTONIAN AND QUALITATIVE MODEL
Authors: VANDERAVOIRD A OLTHOF EHT WORMER PES
Citation: A. Vanderavoird et al., TUNNELING DYNAMICS, SYMMETRY, AND FAR-INFRARED SPECTRUM OF THE ROTATING WATER TRIMER .1. HAMILTONIAN AND QUALITATIVE MODEL, The Journal of chemical physics, 105(18), 1996, pp. 8034-8050
TUNNELING DYNAMICS, SYMMETRY, AND FAR-INFRARED SPECTRUM OF THE ROTATING WATER TRIMER .2. CALCULATIONS AND EXPERIMENTS
Authors: OLTHOF EHT VANDERAVOIRD A WORMER PES LIU K SAYKALLY RJ
Citation: Eht. Olthof et al., TUNNELING DYNAMICS, SYMMETRY, AND FAR-INFRARED SPECTRUM OF THE ROTATING WATER TRIMER .2. CALCULATIONS AND EXPERIMENTS, The Journal of chemical physics, 105(18), 1996, pp. 8051-8063
VIBRATION AND ROTATION OF CO IN C(60) AND PREDICTED INFRARED-SPECTRUM
Authors: OLTHOF EHT VANDERAVOIRD A WORMER PES
Citation: Eht. Olthof et al., VIBRATION AND ROTATION OF CO IN C(60) AND PREDICTED INFRARED-SPECTRUM, The Journal of chemical physics, 104(3), 1996, pp. 832-847
UNAMBIGUOUS ASSIGNMENT OF THE VAN-DER-WAALS MODES OF BENZENE-AR BY ANALYSIS OF THE ROTATIONALLY RESOLVED UV-SPECTRA AND COMPARISON WITH MULTIDIMENSIONAL CALCULATIONS
Authors: RIEDLE E VANDERAVOIRD A
Citation: E. Riedle et A. Vanderavoird, UNAMBIGUOUS ASSIGNMENT OF THE VAN-DER-WAALS MODES OF BENZENE-AR BY ANALYSIS OF THE ROTATIONALLY RESOLVED UV-SPECTRA AND COMPARISON WITH MULTIDIMENSIONAL CALCULATIONS, The Journal of chemical physics, 104(3), 1996, pp. 882-898
AB-INITIO COLLISION-INDUCED POLARIZABILITY, POLARIZED AND DEPOLARIZEDRAMAN-SPECTRA, AND 2ND DIELECTRIC VIRIAL-COEFFICIENT OF THE HELIUM DIATOM
Authors: MOSZYNSKI R HEIJMEN TGA WORMER PES VANDERAVOIRD A
Citation: R. Moszynski et al., AB-INITIO COLLISION-INDUCED POLARIZABILITY, POLARIZED AND DEPOLARIZEDRAMAN-SPECTRA, AND 2ND DIELECTRIC VIRIAL-COEFFICIENT OF THE HELIUM DIATOM, The Journal of chemical physics, 104(18), 1996, pp. 6997-7007
Risultati: 1-25 | 26-48