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Quantum mechanical and machine learning prediction of rotational energy barriers in halogenated aromatic alcohols

Published Online: 2025-02-24

Published Print: 2025-03

Authors

Cerabona, Steven T.

Brown, Gordon G.

Casabianca, Leah B. https://orcid.org/0000-0001-9447-3236
Funding

Funding for this research was provided by:

National Science Foundation (CHE-1751529, CHE-1751529)

Clemson University
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Text and Data Mining valid from 2025-02-24

Version of Record valid from 2025-02-24
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Article History

Received: 13 December 2024

Accepted: 12 February 2025

First Online: 24 February 2025

Declarations

:

: The authors declare no competing interests.

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