Parametric broadening of the molecular vibronic band due to zero-point oscillations and thermal fluctuations of interatomic bonds
Numerous computations of the spectra of molecules are performed by mainstream methods based on the fundamental work by Lax [J. Chem. Phys. 20, 1752 (1952)] for smoothing a series of individual transitions represented by delta functions. There is an assumption that the linewidth of an individual rovi...
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| Format: | Article |
| Language: | English |
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AIP Publishing LLC
2021-03-01
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| Series: | AIP Advances |
| Online Access: | http://dx.doi.org/10.1063/5.0047044 |