Completely Computational Model Setup for Spectroscopic Techniques: The Ab Initio Molecular Dynamics Indirect Hard Modeling Approach
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Title
Completely Computational Model Setup for Spectroscopic Techniques: The Ab Initio Molecular Dynamics Indirect Hard Modeling Approach
Authors
Keywords
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Journal
JOURNAL OF PHYSICAL CHEMISTRY A
Volume 126, Issue 18, Pages 2845-2853
Publisher
American Chemical Society (ACS)
Online
2022-04-28
DOI
10.1021/acs.jpca.2c01061
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