3 Publikationen

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  • [3]
    2018 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2919057
    Wittenbrink N, Eisfeld W (2018)
    Extension of the effective relativistic coupling by asymptotic representation (ERCAR) approach to multi-dimensional potential energy surfaces: 3D model for CH3I.
    JOURNAL OF CHEMICAL PHYSICS 148(9): 12.
    PUB | DOI | WoS
     
  • [2]
    2017 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2911006
    Wittenbrink N, Eisfeld W (2017)
    An improved spin-orbit coupling model for use within the effective relativistic coupling by asymptotic representation (ERCAR) method.
    JOURNAL OF CHEMICAL PHYSICS 146(14): 144110.
    PUB | DOI | WoS | PubMed | Europe PMC
     
  • [1]
    2016 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2907730
    Wittenbrink N, Venghaus F, Williams D, Eisfeld W (2016)
    A new approach for the development of diabatic potential energy surfaces: Hybrid block-diagonalization and diabatization by ansatz.
    JOURNAL OF CHEMICAL PHYSICS 145(18): 184108.
    PUB | DOI | WoS | PubMed | Europe PMC
     

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