P
Per Jensen
Researcher at University of Wuppertal
Publications - 250
Citations - 8448
Per Jensen is an academic researcher from University of Wuppertal. The author has contributed to research in topics: Ab initio & Ground state. The author has an hindex of 45, co-authored 250 publications receiving 8124 citations. Previous affiliations of Per Jensen include Dresden University of Technology & Niels Bohr Institute.
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Computational Molecular Spectroscopy
Per Jensen,Philip R. Bunker +1 more
TL;DR: In this paper, the Born-Oppenheimer approximation is replaced with the Renner effect, which is used to calculate the Ab Initio Molecular Dynamics (A. Sarka and J. Demaison). Variational Calculations of Rotation-Vibration Spectra (J. Tennyson).
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The potential surface and stretching frequencies of X̃ 3B1 methylene (CH2) determined from experiment using the Morse oscillator‐rigid bender internal dynamics Hamiltonian
Per Jensen,P. R. Bunker +1 more
TL;DR: In this article, the Morse oscillator-rigid bender internal dynamics (MORBID) Hamiltonian was used in a fitting to all extant rotation-vibration data for X 3B1 methylene CH2.
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Theoretical ROVibrational Energies (TROVE) : A robust numerical approach to the calculation of rovibrational energies for polyatomic molecules
TL;DR: Theoretical ROVibrational energies for general polyatomic molecules of arbitrary structure in isolated electronic states have been studied in this paper, where the approximate nuclear kinetic energy operator is represented as an expansion in terms of internal coordinates.
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A new morse oscillator-rigid bender internal dynamics (MORBID) Hamiltonian for triatomic molecules
TL;DR: In this paper, the rotation-vibration Hamiltonian for a triatomic molecule is derived in terms of two bond-length displacements Δ r 12 and Δ r 32 and a bending coordinate ϱ defined as in the approach described by J. T. Hougen, P. R. Bunker, and J. W. Johns.