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Автор F X Gadéa
Автор F Gemperle
Автор H Berriche
Автор P Villarreal
Автор G Delgado Barrio
Дата выпуска 1997-06-28
dc.description The energy shift of the vibrational levels of the X and A states due to the vibronic interactions within the manifold of states is accurately determined using a diabatic representation. These vibronic shifts which measure the breakdown of the Born - Oppenheimer approach are compared with the usual estimation where only the adiabatic correction is taken into account. The adiabatic corrections lead to a systematic overestimation of the full vibronic shift for the ground state and to an underestimation for the A one. These results have been related to the interstate dynamical couplings and rationalized using perturbative arguments. Their validity is expected to be very general.
Формат application.pdf
Издатель Institute of Physics Publishing
Название Vibronic shifts for LiH in X and A states
Тип lett
DOI 10.1088/0953-4075/30/12/002
Electronic ISSN 1361-6455
Print ISSN 0953-4075
Журнал Journal of Physics B: Atomic, Molecular and Optical Physics
Том 30
Первая страница L427
Последняя страница L434
Выпуск 12

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