Computational infrared and Raman spectra by hybrid QM/MM techniques: a study on molecular and catalytic material systems. (2023)


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Bibliographic Information

Digital Object Identifier:

PubMed Identifier: 37211033

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Type: Journal Article/Review

Volume: 381

Parent Publication: Philosophical transactions. Series A, Mathematical, physical, and engineering sciences

Issue: 2250

ISSN: 1364-503X