Prediction of the photoelectron spectra of C122 by computing Franck-Condon factors
The computation of Franck-Condon factors plays a key role for unraveling vibronic spectra and nonradiative process of molecules. In this work the photoelectron spectra of C122 were predicted by computing Franck-Condon factors. The equilibrium geometries and harmonic vibrational frequencies of five a...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
AIP Publishing LLC
2019-06-01
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| Series: | AIP Advances |
| Online Access: | http://dx.doi.org/10.1063/1.5108848 |