Publikationen

2024

Lebeda, Timo; Aschebrock, Thilo; Kümmel, Stephan
Balancing the Contributions to the Gradient Expansion : Accurate Binding and Band Gaps with a N ...
In: Physical Review Letters Bd. 133 (2024) Heft 13
doi:10.1103/PhysRevLett.133.136402 ...

Brütting, Moritz; Bahmann, Hilke; Kümmel, Stephan
Combining Local Range Separation and Local Hybrids : A Step in the Quest for Obtaining Good Ene ...
In: The Journal of Physical Chemistry A Bd. 128 (2024) Heft 26. - S. 5212-5223
doi:10.1021/acs.jpca.4c02787 ...

Brütting, Moritz; Bahmann, Hilke; Kümmel, Stephan
Predicting fundamental gaps accurately from density functional theory with non-empirical local ...
In: The Journal of Chemical Physics Bd. 160 (2024) Heft 18
doi:10.1063/5.0204379 ...