It was found to have equilibrium geometry with all frequencies real at the second-order M? ller-Plesset perturbation (MP2/aug-cc-pvdz+BF) level.

  • 在二级微扰理论的计算下(MP2/aug-cc-pvdz+BF),体系平衡几何的频率计算值都为正。
目录 查词历史