3 Publikationen

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  • [3]
    2019 | Dissertation | PUB-ID: 2935983
    Venghaus F (2019)
    Development of novel techniques for the robust diabatization of accurate electronic structure data.
    Bielefeld: Universität Bielefeld.
    PUB
     
  • [2]
    2016 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2903041
    Venghaus F, Eisfeld W (2016)
    Block-diagonalization as a tool for the robust diabatization of high-dimensional potential energy surfaces.
    JOURNAL OF CHEMICAL PHYSICS 144(11): 114110.
    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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