Ab initio calculation of rovibrational states...

The Journal of Chemical Physics 2020 / 05 Vol. 152; Iss. 17

Ab initio calculation of rovibrational states for non-degenerate double-well potentials: cis – trans isomerization of HOPO

Erfort, Sebastian, Tschöpe, Martin, Rauhut, Guntram, Zeng, Xiaoqing, Tew, David P.
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Volume:
152
Journal:
The Journal of Chemical Physics
DOI:
10.1063/5.0005497
Date:
May, 2020
File:
PDF, 1.42 MB
2020
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