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Assessment of various density functionals and basis sets for the calculation of molecular anharmonic force fields

Assessment of various density functionals and basis sets for the calculation of molecular anharmonic force fields

A. Daniel Boese; Wim Klopper; Jan M. L. Martin
  • 作者A. Daniel Boese; Wim Klopper; Jan M. L. Martin
  • 卷第104卷
  • 期第5期
  • 印刷ISSN0020-7608
  • 电子ISSN1097-461X
  • 文件大小208.69KB
  • 发表时间2005
  • DOI10.1002/qua.20644
  • 页码830-845
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