发现好书期刊，享受阅读乐趣

海量图书期刊资源，随时随地畅享阅读乐趣

A Standard Set of Pericyclic Reactions of Hydrocarbons for the Benchmarking of Computational Methods:  The Performance of ab Initio, Density Functional, CASSCF, CASPT2, and CBS-QB3 Methods for the Prediction of Activation Barriers, Reaction Energetics, and Transition State Geometries

A Standard Set of Pericyclic Reactions of Hydrocarbons for the Benchmarking of Computational Methods:  The Performance of ab Initio, Density Functional, CASSCF, CASPT2, and CBS-QB3 Methods for the Prediction of Activation Barriers, Reaction Energetics, and Transition State Geometries

Guner, Vildan; Khuong, Kelli S.; Leach, Andrew G.; Lee, Patrick S.; Bartberger, Michael D.; Houk, K. N.
  • 作者Guner, Vildan; Khuong, Kelli S.; Leach, Andrew G.; Lee, Patrick S.; Bartberger, Michael D.; Houk, K. N.
  • 卷第107卷
  • 期第51期
  • 印刷ISSN1089-5639
  • 文件大小473.54KB
  • 发表时间2003
  • DOI10.1021/jp035501w
  • 页码11445-11459
同作者推荐
同期刊推荐
← 返回【学霸图书馆】主页
© 2026 学霸图书馆 · 让阅读成为习惯