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1 Ergebnisse
1
Artificial-Intelligence-Enhanced On-the-Fly Simulation of N..:
Sebastian V. Pios
;
Maxim F. Gelin
;
Arif Ullah
..
doi:10.1021/acs.jpclett.4c00107.s002. , 2024
Link:
https://doi.org/10.1021/acs.jpclett.4c00107.s002
RT Journal T1
Artificial-Intelligence-Enhanced On-the-Fly Simulation of Nonlinear Time-Resolved Spectra
UL https://suche.suub.uni-bremen.de/peid=base-ftgriffithunifig:oai:figshare.com:article_25269994&Exemplar=1&LAN=DE A1 Sebastian V. Pios A1 Maxim F. Gelin A1 Arif Ullah A1 Pavlo O. Dral A1 Lipeng Chen YR 2024 K1 Biochemistry K1 Medicine K1 Biological Sciences not elsewhere classified K1 Chemical Sciences not elsewhere classified K1 Physical Sciences not elsewhere classified K1 Information Systems not elsewhere classified K1 ab initio </ K1 dimensional electronic spectra K1 resolved electronic spectra K1 simulating nonlinear time K1 resolved spectra time K1 nonlinear time K1 produces spectra K1 resolved spectroscopy K1 wider adoption K1 transient absorption K1 theoretical simulations K1 technological significance K1 systems must K1 structural changes K1 simulations affordable K1 pure first K1 prototypical molecule K1 principles simulations K1 principles methods K1 often indispensable K1 minute details K1 least 95 K1 increasing size K1 important tool K1 hopping simulations K1 high precision K1 fly surface K1 fly simulation K1 existing first K1 drastically reduce K1 computational cost K1 challenging task K1 accurate simulations JF doi:10.1021/acs.jpclett.4c00107.s002 LK http://dx.doi.org/https://doi.org/10.1021/acs.jpclett.4c00107.s002 DO https://doi.org/10.1021/acs.jpclett.4c00107.s002 SF ELIB - SuUB Bremen
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