Toward a fully automated calculation of rovibrational infrared intensities for semi-rigid polyatomic molecules
Erfort, Sebastian, Tschöpe, Martin, Rauhut, GuntramVolume:
152
Journal:
The Journal of Chemical Physics
DOI:
10.1063/5.0011832
Date:
June, 2020
File:
PDF, 2.54 MB
2020