Isotope Effects on the Electronic Spectra of Ammonia from Ab Initio Semiclassical Dynamics-Reference-Cited by-同舟云学术

Isotope Effects on the Electronic Spectra of Ammonia from Ab Initio Semiclassical Dynamics

Published:2023-09-22 Issue:39 Volume:127 Page:8117-8125
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Klētnieks Ēriks¹,Alonso Yannick Calvino¹^ORCID,Vaníček Jiří J. L.¹^ORCID

Affiliation:

1. Laboratory of Theoretical Physical Chemistry, Institut des Sciences et Ingénierie Chimiques, Ecole Polytechnique Fédérale de Lausanne (EPFL), Lausanne CH-1015, Switzerland

Funder

?cole Polytechnique F?d?rale de Lausanne

H2020 European Research Council

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.3c04607

Reference64 articles.

1. Zur Quantentheorie der Molekeln

2. Heller, E. J. The Semiclassical Way to Dynamics and Spectroscopy; Princeton University Press: Princeton, NJ, 2018, p 472.

3. Wilson, E.; Decius, J.; Cross, P. Molecular Vibrations: The Theory of Infrared and Raman Vibrational Spectra; Dover Publications, 1980, p 416.

4. Harris, D. C.; Bertolucci, M. D. Symmetry and Spectroscopy; Oxford University Press: New York, NY, 1989, p 284.

5. Comparison of various Franck–Condon and vibronic coupling approaches for simulating electronic spectra: The case of the lowest photoelectron band of ethylene

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