Polarizable Embedding for the Algebraic-Diagrammatic Construction Scheme
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Bester Preis: € 3,07 (vom 30.07.2020)1
Polarizable Embedding for the Algebraic-Diagrammatic Construction Scheme
~EN PB NWISBN: 9783658312800 bzw. 3658312807, vermutlich in Englisch, Springer Shop, Taschenbuch, neu.
Lieferung aus: Deutschland, Lagernd.
Maximilian Scheurer presents a method for modeling excited states in atomistic, heterogeneous environments. The method utilizes the polarizable embedding (PE) model to mimic electrostatic and polarization interactions of a molecule with its environment. For high-level modeling of the molecule’s excited states, the algebraic-diagrammatic construction scheme for the polarization propagator (ADC) is employed. The presented work outlines the theoretical foundations of PE and ADC and the combination of both methods, termed PE-ADC. The accuracy of PE-ADC is tested, and the charge-transfer (CT) excitation in the dodecin protein is studied. This book presents a comprehensive elaboration on the new PE-ADC method and a state-of-the-art application of PE-ADC to a photo-biochemical process. Soft cover.
Maximilian Scheurer presents a method for modeling excited states in atomistic, heterogeneous environments. The method utilizes the polarizable embedding (PE) model to mimic electrostatic and polarization interactions of a molecule with its environment. For high-level modeling of the molecule’s excited states, the algebraic-diagrammatic construction scheme for the polarization propagator (ADC) is employed. The presented work outlines the theoretical foundations of PE and ADC and the combination of both methods, termed PE-ADC. The accuracy of PE-ADC is tested, and the charge-transfer (CT) excitation in the dodecin protein is studied. This book presents a comprehensive elaboration on the new PE-ADC method and a state-of-the-art application of PE-ADC to a photo-biochemical process. Soft cover.
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Polarizable Embedding for the Algebraic-Diagrammatic Construction Scheme (2020)
DE HC NWISBN: 9783658312800 bzw. 3658312807, in Deutsch, Springer Fachmedien Wiesbaden, gebundenes Buch, neu.
Lieferung aus: Deutschland, Versandkostenfrei, Shipping in 3 days.
Die Beschreibung dieses Angebotes ist von geringer Qualität oder in einer Fremdsprache. Trotzdem anzeigen
Die Beschreibung dieses Angebotes ist von geringer Qualität oder in einer Fremdsprache. Trotzdem anzeigen
3
Polarizable Embedding for the Algebraic-Diagrammatic Construction Scheme: Investigating Photoexcitations in Large Biomolecular Systems Maximilian Sche
~EN PB NWISBN: 9783658312800 bzw. 3658312807, vermutlich in Englisch, Springer Fachmedien Wiesbaden, Taschenbuch, neu.
Lieferung aus: Vereinigte Staaten von Amerika, zzgl. Versandkosten.
Polarizable Embedding for the Algebraic Diagrammatic Construction Scheme,Maximilian Scheurer.
Polarizable Embedding for the Algebraic Diagrammatic Construction Scheme,Maximilian Scheurer.
4
Polarizable Embedding for the Algebraic-Diagrammatic Construction Scheme
~EN NWISBN: 3658312807 bzw. 9783658312800, vermutlich in Englisch, neu.
Die Beschreibung dieses Angebotes ist von geringer Qualität oder in einer Fremdsprache. Trotzdem anzeigen
5
Polarizable Embedding for the Algebraic-Diagrammatic Construction Scheme (2020)
~EN PB NW FEISBN: 9783658312800 bzw. 3658312807, vermutlich in Englisch, Springer Fachmedien Wiesbaden GmbH, Taschenbuch, neu, Erstausgabe.
Lieferung aus: Deutschland, Versandkostenfrei in der BRD, Versand in 10-14 Tagen.
Investigating Photoexcitations in Large Biomolecular Systems, Buch, Softcover, 1st ed. 2020.
Investigating Photoexcitations in Large Biomolecular Systems, Buch, Softcover, 1st ed. 2020.
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