58 citations · 89 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2019★ 31 cited
On-the-fly ab initio three thawed Gaussians approximation: A semiclassical approach to Herzberg-Teller spectra
Tomislav Begušić, Aurélien Patoz, Miroslav Šulc +1
Evaluation of symmetry-forbidden or weakly-allowed vibronic spectra requires treating the transition dipole moment beyond the Condon approximation. To include vibronic spectral fea…
physics.chem-ph2018★ 58 cited
On-the-fly ab initio semiclassical evaluation of absorption spectra of polyatomic molecules beyond the Condon approximation
Aurélien Patoz, Tomislav Begušić, Jiří Vaníček
To evaluate vibronic spectra beyond the Condon approximation, we extend the on-the-fly ab initio thawed Gaussian approximation by considering the Herzberg-Teller contribution due t…