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1 Ergebnisse
1
Assessment of State-Averaged Driven Similarity Renormalizat..:
Meng Wang (124646)
;
Wei-Hai Fang (1268982)
;
Chenyang Li (532326)
https://figshare.com/articles/journal_contribution/Assessment_of_State-Averaged_Driven_Similarity_Renormalization_Group_on_Vertical_Excitation_Energies_Optimal_Flow_Parameters_and_Applications_to_Nucleobases/21751674. , 2022
Link:
https://doi.org/10.1021/acs.jctc.2c00966.s001
RT Journal T1
Assessment of State-Averaged Driven Similarity Renormalization Group on Vertical Excitation Energies: Optimal Flow Parameters and Applications to Nucleobases
UL https://suche.suub.uni-bremen.de/peid=base-ftunivfreestate:oai:figshare.com:article_21751674&Exemplar=1&LAN=DE A1 Meng Wang (124646) A1 Wei-Hai Fang (1268982) A1 Chenyang Li (532326) YR 2022 K1 Medicine K1 Sociology K1 Computational Biology K1 Space Science K1 Biological Sciences not elsewhere classified K1 Physical Sciences not elsewhere classified K1 Information Systems not elsewhere classified K1 vertical excitation energies K1 theoretical best estimates K1 potential – electron K1 order perturbation theories K1 mean absolute error K1 lying singlet states K1 09 ev ) K1 p .- f K1 dsrg derived second K1 c K1 evangelista K1 optimal flow parameter K1 pt2 scheme outperforms K1 dsrg hierarchy using K1 π → π K1 optimal flow parameters K1 f K1 boggio K1 mae ) K1 yet K1 → π K1 flow parameter K1 computed using K1 10 ev K1 scemama K1 loos K1 lipparini K1 jacquemin K1 caffarel K1 2 ) K1 ́ ril K1 wiley interdiscip K1 slightly inferior K1 sized molecules K1 several low K1 quest database K1 nonperturbative approach K1 n </ JF https://figshare.com/articles/journal_contribution/Assessment_of_State-Averaged_Driven_Similarity_Renormalization_Group_on_Vertical_Excitation_Energies_Optimal_Flow_Parameters_and_Applications_to_Nucleobases/21751674 LK http://dx.doi.org/https://doi.org/10.1021/acs.jctc.2c00966.s001 DO https://doi.org/10.1021/acs.jctc.2c00966.s001 SF ELIB - SuUB Bremen
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