Fast Nonadiabatic Molecular Dynamics via Spin-Flip Time-Dependent Density-Functional Tight-Binding Approach: Application to Nonradiative Relaxation of Tetraphenylethylene with Locked Aromatic Rings

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Title
Fast Nonadiabatic Molecular Dynamics via Spin-Flip Time-Dependent Density-Functional Tight-Binding Approach: Application to Nonradiative Relaxation of Tetraphenylethylene with Locked Aromatic Rings
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 16, Issue 12, Pages 7299-7313
Publisher
American Chemical Society (ACS)
Online
2020-11-17
DOI
10.1021/acs.jctc.0c00936

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