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  <identifier identifierType="DOI">10.18453/rosdok_id00002484</identifier>
  <creators>
    <creator>
      <creatorName nameType="Personal">Karsten, Sven</creatorName>
      <givenName>Sven</givenName>
      <familyName>Karsten</familyName>
      <nameIdentifier nameIdentifierScheme="GND" schemeURI="http://d-nb.info/gnd/">http://d-nb.info/gnd/1190746840</nameIdentifier>
    </creator>
  </creators>
  <titles>
    <title>Trajectory-based approaches to vibronic spectroscopy of molecular systems</title>
  </titles>
  <publisher>Universität Rostock</publisher>
  <publicationYear>2018</publicationYear>
  <resourceType resourceTypeGeneral="Text" />
  <subjects>
    <subject xml:lang="en" schemeURI="http://dewey.info/" subjectScheme="dewey">530 Physics</subject>
  </subjects>
  <dates>
    <date dateType="Created">2018</date>
  </dates>
  <language>en</language>
  <alternateIdentifiers>
    <alternateIdentifier alternateIdentifierType="PURL">http://purl.uni-rostock.de/rosdok/id00002484</alternateIdentifier>
    <alternateIdentifier alternateIdentifierType="URN">urn:nbn:de:gbv:28-rosdok_id00002484-6</alternateIdentifier>
  </alternateIdentifiers>
  <descriptions>
    <description descriptionType="Abstract">The goal of this thesis is to bridge the gap between the two standard theoretical approaches to vibronic spectroscopy via trajectory-based methods. As the starting point, a generalized time-correlation function is introduced and the ring-polymer molecular dynamics method is generalized to vibronic transitions, yielding an improvement over known classical approximations. Further, the vibronic spectrum is evaluated via the Matsubara dynamics. Employing an ad-hoc modification, the sign problem of the Matsubara method can be circumvented and the spectra of model systems are adequately simulated.</description>
  </descriptions>
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