Matches in SemOpenAlex for { <https://semopenalex.org/work/W2072503241> ?p ?o ?g. }
- W2072503241 abstract "In this paper, we perform many-electron dynamics using the time-dependent configuration-interaction method in its reduced density matrix formulation (ρ-TDCI). Dissipation is treated implicitly using the Lindblad formalism. To include the effect of ionization on the state-resolved dynamics, we extend a recently introduced heuristic model for ionizing states to the ρ-TDCI method, which leads to a reduced density matrix evolution that is not norm-preserving. We apply the new method to the laser-driven excitation of documentclass[12pt]{minimal}begin{document}${rm H}_2$end{document}H2 in a strongly dissipative environment, for which the state-resolve lifetimes are tuned to a few femtoseconds, typical for dynamics of adsorbate at metallic surfaces. Further testing is made on the laser-induced intramolecular charge transfer in a quinone derivative as a model for a molecular switch. A modified scheme to treat ionizing states is proposed to reduce the computational burden associated with the density matrix propagation, and it is thoroughly tested and compared to the results obtained with the former model. The new approach scales favorably (documentclass[12pt]{minimal}begin{document}$sim N^2$end{document}∼N2) with the number of configurations N used to represent the reduced density matrix in the ρ-TDCI method, as compared to a documentclass[12pt]{minimal}begin{document}$N^3$end{document}N3 scaling for the model in its original form." @default.
- W2072503241 created "2016-06-24" @default.
- W2072503241 creator A5032510191 @default.
- W2072503241 creator A5061906414 @default.
- W2072503241 creator A5081895623 @default.
- W2072503241 creator A5090354315 @default.
- W2072503241 date "2011-01-28" @default.
- W2072503241 modified "2023-10-02" @default.
- W2072503241 title "Dissipative many-electron dynamics of ionizing systems" @default.
- W2072503241 cites W1970410129 @default.
- W2072503241 cites W1975613135 @default.
- W2072503241 cites W1977146182 @default.
- W2072503241 cites W1977908760 @default.
- W2072503241 cites W1981717389 @default.
- W2072503241 cites W1987698184 @default.
- W2072503241 cites W1988949141 @default.
- W2072503241 cites W1992942238 @default.
- W2072503241 cites W2001378472 @default.
- W2072503241 cites W2008006945 @default.
- W2072503241 cites W2015683881 @default.
- W2072503241 cites W2015709666 @default.
- W2072503241 cites W2021707514 @default.
- W2072503241 cites W2022950330 @default.
- W2072503241 cites W2023869963 @default.
- W2072503241 cites W2028354704 @default.
- W2072503241 cites W2029549791 @default.
- W2072503241 cites W2030337125 @default.
- W2072503241 cites W2032839191 @default.
- W2072503241 cites W2034815131 @default.
- W2072503241 cites W2042859213 @default.
- W2072503241 cites W2043181099 @default.
- W2072503241 cites W2045261180 @default.
- W2072503241 cites W2049137131 @default.
- W2072503241 cites W2051320616 @default.
- W2072503241 cites W2051483215 @default.
- W2072503241 cites W2055515988 @default.
- W2072503241 cites W2058175549 @default.
- W2072503241 cites W2061507424 @default.
- W2072503241 cites W2064407251 @default.
- W2072503241 cites W2066847116 @default.
- W2072503241 cites W2072563608 @default.
- W2072503241 cites W2073904571 @default.
- W2072503241 cites W2076992724 @default.
- W2072503241 cites W2081247166 @default.
- W2072503241 cites W2082016542 @default.
- W2072503241 cites W2085876101 @default.
- W2072503241 cites W2086174873 @default.
- W2072503241 cites W2087317174 @default.
- W2072503241 cites W2088597463 @default.
- W2072503241 cites W2088887451 @default.
- W2072503241 cites W2106487474 @default.
- W2072503241 cites W2108744232 @default.
- W2072503241 cites W2110232958 @default.
- W2072503241 cites W2129401063 @default.
- W2072503241 cites W2129489470 @default.
- W2072503241 cites W4245770866 @default.
- W2072503241 cites W4251199203 @default.
- W2072503241 doi "https://doi.org/10.1063/1.3532410" @default.
- W2072503241 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/21280729" @default.
- W2072503241 hasPublicationYear "2011" @default.
- W2072503241 type Work @default.
- W2072503241 sameAs 2072503241 @default.
- W2072503241 citedByCount "30" @default.
- W2072503241 countsByYear W20725032412012 @default.
- W2072503241 countsByYear W20725032412015 @default.
- W2072503241 countsByYear W20725032412016 @default.
- W2072503241 countsByYear W20725032412017 @default.
- W2072503241 countsByYear W20725032412018 @default.
- W2072503241 countsByYear W20725032412020 @default.
- W2072503241 countsByYear W20725032412021 @default.
- W2072503241 countsByYear W20725032412022 @default.
- W2072503241 countsByYear W20725032412023 @default.
- W2072503241 crossrefType "journal-article" @default.
- W2072503241 hasAuthorship W2072503241A5032510191 @default.
- W2072503241 hasAuthorship W2072503241A5061906414 @default.
- W2072503241 hasAuthorship W2072503241A5081895623 @default.
- W2072503241 hasAuthorship W2072503241A5090354315 @default.
- W2072503241 hasConcept C121332964 @default.
- W2072503241 hasConcept C121864883 @default.
- W2072503241 hasConcept C126255220 @default.
- W2072503241 hasConcept C130787639 @default.
- W2072503241 hasConcept C145148216 @default.
- W2072503241 hasConcept C147120987 @default.
- W2072503241 hasConcept C167735695 @default.
- W2072503241 hasConcept C184779094 @default.
- W2072503241 hasConcept C185592680 @default.
- W2072503241 hasConcept C198291218 @default.
- W2072503241 hasConcept C2524010 @default.
- W2072503241 hasConcept C33923547 @default.
- W2072503241 hasConcept C520434653 @default.
- W2072503241 hasConcept C56911000 @default.
- W2072503241 hasConcept C62520636 @default.
- W2072503241 hasConcept C75079739 @default.
- W2072503241 hasConcept C83581075 @default.
- W2072503241 hasConcept C84114770 @default.
- W2072503241 hasConcept C99692599 @default.
- W2072503241 hasConcept C99844830 @default.
- W2072503241 hasConceptScore W2072503241C121332964 @default.
- W2072503241 hasConceptScore W2072503241C121864883 @default.
- W2072503241 hasConceptScore W2072503241C126255220 @default.