화학공학소재연구정보센터
검색결과 : 13건
No. Article
1 Electronic Excited States and UV-Vis Absorption Spectra of the Dihydropyrene/Cyclophanediene Photochromic Couple: a Theoretical Investigation
Sarkar R, Heitz MC, Royal G, Boggio-Pasqua M
Journal of Physical Chemistry A, 124(8), 1567, 2020
2 Relaxation Dynamics of Photoexcited Calcium Deposited on Argon Clusters: Theoretical Simulation of Time-Resolved Photoelectron Spectra
Heitz MC, Teixidor L, Van-Oanh NT, Spiegelman F
Journal of Physical Chemistry A, 114(9), 3287, 2010
3 Evidence for a non-Rydberg molecular doubly excited state of Ca-2
Gaveau MA, Mestdagh JM, Bouissou T, Durand G, Heitz MC, Spiegelman F
Chemical Physics Letters, 467(4-6), 260, 2009
4 Different approaches for the calculation of electronic excited states of nonstoichiometric alkali halide clusters: The example of Na3F
Durand G, Heitz MC, Spiegelman F, Meier C, Mitric R, Bonacic-Koutecky V, Pittner J
Journal of Chemical Physics, 121(20), 9898, 2004
5 Ultrafast excited state dynamics of the Na3F cluster: Quantum wave packet and classical trajectory calculations compared to experimental results
Heitz MC, Durand G, Spiegelman F, Meier C, Mitric R, Bonacic-Koutecky V
Journal of Chemical Physics, 121(20), 9906, 2004
6 Time-resolved photoelectron spectra as probe of excited state dynamics: A full quantum study of the Na2F cluster
Heitz MC, Durand G, Spiegelman F, Meier C
Journal of Chemical Physics, 118(3), 1282, 2003
7 Theoretical study of finite-temperature spectroscopy in van der Waals clusters. I. Probing phase changes in CaArn
Calvo F, Spiegelman F, Heitz MC
Journal of Chemical Physics, 118(19), 8739, 2003
8 Quantum-classical description of rotational diffractive scattering using Bohmian trajectories: Comparison with full quantum wave packet results
Gindensperger E, Meier C, Beswick JA, Heitz MC
Journal of Chemical Physics, 116(23), 10051, 2002
9 Rotational and diffractive inelastic scattering of a diatom on a corrugated surface: A multiconfiguration time-dependent Hartree study on N-2/LiF(001)
Heitz MC, Meyer HD
Journal of Chemical Physics, 114(3), 1382, 2001
10 Reaction cross sections for the H+D-2 (nu = 0,1) system for collision energies up to 2.5 eV: A multiconfiguration time-dependent Hartree wave-packet propagation study
Jackle A, Heitz MC, Meyer HD
Journal of Chemical Physics, 110(1), 241, 1999