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- W3045936290 abstract "My approach to include contributions from PE in ADC calculations of excitation energies is fully density-driven and based on perturbative, a posteriori corrections. As a consequence, the expressions for the ADC secular matrix (eq (2.43)) elements do not change. A similar approach was pursued for the combination of PCM with ADC[40,41] or the effective fragment potential (EFP)[54–58] method with EOM-CCSD[59,60], for example." @default.
- W3045936290 created "2020-08-03" @default.
- W3045936290 creator A5017202349 @default.
- W3045936290 date "2020-01-01" @default.
- W3045936290 modified "2023-09-25" @default.
- W3045936290 title "Combination of PE and ADC" @default.
- W3045936290 doi "https://doi.org/10.1007/978-3-658-31281-7_3" @default.
- W3045936290 hasPublicationYear "2020" @default.
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