Efficient Construction of Excited-State Hessian Matrices with Machine Learning Accelerated Multilayer Energy-Based Fragment Method

Published 2020 View Full Article

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Title
Efficient Construction of Excited-State Hessian Matrices with Machine Learning Accelerated Multilayer Energy-Based Fragment Method
Authors
Keywords
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Journal
JOURNAL OF PHYSICAL CHEMISTRY A
Volume 124, Issue 27, Pages 5684-5695
Publisher
American Chemical Society (ACS)
Online
2020-06-13
DOI
10.1021/acs.jpca.0c04117

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