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- [1] AN ABINITIO STUDY OF THE ROTATIONAL POTENTIAL-ENERGY SURFACE OF CIS-TRANSOIDAL POLYACETYLENE JOURNAL OF MACROMOLECULAR SCIENCE-CHEMISTRY, 1988, A25 (02): : 159 - 169
- [3] An ab initio study of the potential energy surface of methylamine dimer JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2002, 586 : 225 - 234
- [4] Conductivity in polyacetylene. I. Ab initio calculation of charge localization, bond distances, and reorganization energy in model molecules Journal of Chemical Physics, 1995, 102 (18):
- [5] An accurate ab initio HOCl potential energy surface, vibrational and rotational calculations, and comparison with experiment JOURNAL OF CHEMICAL PHYSICS, 1998, 109 (07): : 2662 - 2671
- [6] AN AB-INITIO STUDY OF THE FCP POTENTIAL-ENERGY SURFACE JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1995, 339 : 39 - 44
- [7] Ab initio potential energy surface and vibrational-rotational energy levels of X2Σ+ CaOH JOURNAL OF PHYSICAL CHEMISTRY A, 2002, 106 (41): : 9595 - 9599
- [8] The ab initio potential energy surface and vibrational-rotational energy levels of X2Σ+ MgOH JOURNAL OF CHEMICAL PHYSICS, 2002, 117 (04): : 1529 - 1535
- [9] A global ab initio potential energy surface for formaldehyde JOURNAL OF PHYSICAL CHEMISTRY A, 2004, 108 (41): : 8980 - 8986