Showing results (1-10 of 4) with videos related to
Sort By:
Pageof 1
The Journal of Chemical Physics|July 3, 2020
Toward a fully automated calculation of rovibrational infrared intensities for semi-rigid polyatomic moleculesSebastian Erfort, Martin Tschöpe, Guntram RauhutThe Journal of Chemical Physics|April 2, 2022
Efficient and automated quantum chemical calculation of rovibrational nonresonant Raman spectraSebastian Erfort, Martin Tschöpe, Guntram RauhutFrontiers in Chemistry|February 15, 2021
High-Level Rovibrational Calculations on KetenimineMartin Tschöpe, Benjamin Schröder, Sebastian Erfort, et al.The Journal of Chemical Physics|May 10, 2020
Ab initio calculation of rovibrational states for non-degenerate double-well potentials: cis-trans isomerization of HOPOSebastian Erfort, Martin Tschöpe, Guntram Rauhut, et al.Pageof 1