PUB - Publikationen an der Universität Bielefeld

Nils Wittenbrink

PEVZ-ID

[3]

2018 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2919057
Wittenbrink, Nils, and Eisfeld, Wolfgang. “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 (2018): 12.
PUB | DOI | WoS
[2]

2017 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2911006
Wittenbrink, Nils, and Eisfeld, Wolfgang. “An improved spin-orbit coupling model for use within the effective relativistic coupling by asymptotic representation (ERCAR) method”. JOURNAL OF CHEMICAL PHYSICS 146.14 (2017): 144110.
PUB | DOI | WoS | PubMed | Europe PMC
[1]

2016 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2907730
Wittenbrink, Nils, Venghaus, Florian, Williams, David, and Eisfeld, Wolfgang. “A new approach for the development of diabatic potential energy surfaces: Hybrid block-diagonalization and diabatization by ansatz”. JOURNAL OF CHEMICAL PHYSICS 145.18 (2016): 184108.
PUB | DOI | WoS | PubMed | Europe PMC