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- [2] The evaluation of bond dissociation energies for simple sulphur containing molecules using ab initio and density functional methodsJOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1999, 460 (1-3): : 159 - 166Maung, N
- [3] The evaluation of bond dissociation energies for simple selenium-containing molecules using ab initio and density functional methodsJOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1998, 453 (1-3): : 181 - 189Maung, NWilliams, JOWright, AC
- [4] The evaulation of nitrogen containing bond dissociation energies using the ab initio and density functional methods J Molec Struct, 1-2 (103):
- [5] The evaluation of nitrogen containing bond dissociation energies using the ab initio and density functional methodsJOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1996, 366 (1-2): : 103 - 108Jursic, BS
- [6] Assessment of experimental bond dissociation energies using composite ab initio methods and evaluation of the performances of density functional methods in the calculation of bond dissociation energiesJOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES, 2003, 43 (06): : 2005 - 2013Feng, YLiu, LWang, JTHuang, HGuo, QX
- [8] Dissociation energies and kinetics of aminopyrimidinium radicals by ab initio and density functional theoryJOURNAL OF PHYSICAL CHEMISTRY A, 1999, 103 (12): : 1905 - 1912Turecek, FWolken, JK
- [9] Ammonia Dissociation on Graphene Oxide: An Ab Initio Density Functional Theory CalculationZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS, 2015, 229 (7-8): : 1211 - 1223Huang, LiangliangGubbins, Keith E.
- [10] Evaluation of N-H bond dissociation energies in some amides using ab initio and density functional methodsJOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2005, 757 (1-3): : 53 - 59Kaur, DKaur, RP