Path‐Integral Approaches to Non‐Adiabatic Dynamics
dc.contributor.author
Saller, Maximilian
dc.contributor.author
Runeson, Johan E.
dc.contributor.author
Richardson, Jeremy
dc.contributor.editor
González, Leticia
dc.date.accessioned
2020-12-16T07:59:03Z
dc.date.available
2020-12-10T15:04:00Z
dc.date.available
2020-12-16T07:59:03Z
dc.date.issued
2020-11-23
dc.identifier.isbn
978-1-119-41777-4
en_US
dc.identifier.isbn
978-1-119-41775-0
en_US
dc.identifier.other
10.1002/9781119417774.ch20
en_US
dc.identifier.uri
http://hdl.handle.net/20.500.11850/455826
dc.description.abstract
In this chapter, we describe methods for simulating non‐adiabatic dynamics based on the path‐integral formulation of quantum mechanics. In order to employ trajectory calculations to a system of more than one electronic state, we introduce the mapping formalism and explain how this approach can be used with linearized semiclassical or ring‐polymer molecular dynamics.
en_US
dc.language.iso
en
en_US
dc.publisher
Wiley
en_US
dc.subject
equilibrium correlation functions
en_US
dc.subject
non‐adiabatic dynamics
en_US
dc.subject
non‐adiabatic path‐integral theory
en_US
dc.subject
path‐integral approaches
en_US
dc.title
Path‐Integral Approaches to Non‐Adiabatic Dynamics
en_US
dc.type
Book Chapter
dc.date.published
2020-11-27
ethz.book.title
Quantum Chemistry and Dynamics of Excited States: Methods and Applications
en_US
ethz.pages.start
629
en_US
ethz.pages.end
653
en_US
ethz.publication.place
ethz.publication.status
published
en_US
ethz.leitzahl
ETH Zürich::00002 - ETH Zürich::00012 - Lehre und Forschung::00007 - Departemente::02020 - Dep. Chemie und Angewandte Biowiss. / Dep. of Chemistry and Applied Biosc.::02543 - Inst. f. Molekulare Physikalische Wiss. / Institute of Molecular Physical Science::09602 - Richardson, Jeremy / Richardson, Jeremy
en_US
ethz.leitzahl.certified
ETH Zürich::00002 - ETH Zürich::00012 - Lehre und Forschung::00007 - Departemente::02020 - Dep. Chemie und Angewandte Biowiss. / Dep. of Chemistry and Applied Biosc.::02543 - Inst. f. Molekulare Physikalische Wiss. / Institute of Molecular Physical Science::09602 - Richardson, Jeremy / Richardson, Jeremy
en_US
ethz.date.deposited
2020-12-10T15:04:19Z
ethz.source
FORM
ethz.eth
yes
en_US
ethz.availability
Metadata only
en_US
ethz.rosetta.installDate
2020-12-16T07:59:14Z
ethz.rosetta.lastUpdated
2024-02-02T12:41:29Z
ethz.rosetta.versionExported
true
ethz.COinS
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Book Chapter [9533]