The kinetic energy contribution U(ρ) to the potential energy in the Hougen-Bunker-Johns Hamiltonian
作者： K. Sarka , P.R. Bunker
DOI: 10.1016/0022-2852(87)90002-6
关键词: Quantum mechanics 、 Kinetic energy 、 Triatomic molecule 、 Order of magnitude 、 Physics 、 Hamiltonian (quantum mechanics) 、 Potential energy
摘要: Abstract The pseudo potential energy term U ( ρ ) obtained from the kinetic of Hougen-Bunker-Johns (HBJ) rotation-vibration Hamiltonian has been in general to order magnitude κ 2 T v . expression is relatively easy evaluate and should be used any semirigid bender or nonrigid that derived HBJ Hamiltonian.
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