Marcel Müller

发表论文 19 篇 · 总被引 565 次 · h-index 7

代表论文

CREST-A program for the exploration of low-energy molecular chemical space. (2024 · Journal of Chemical Physics · 被引 426)
ωB97X-3c: A composite range-separated hybrid DFT method with a molecule-optimized polarized valence double-ζ basis set. (2022 · Journal of Chemical Physics · 被引 121)
An atom-in-molecule adaptive polarized valence single-ζ atomic orbital basis for electronic structure calculations. (2023 · Journal of Chemical Physics · 被引 49)
A non-self-consistent tight-binding electronic structure potential in a polarized double-ζ basis set for all spd-block elements up to Z = 86. (2023 · Journal of Chemical Physics · 被引 25)
BayBE: a Bayesian Back End for experimental planning in the low-to-no-data regime (2025 · Digital Discovery · 被引 17)
Electrodynamic balance-mass spectrometry reveals impact of oxidant concentration on product composition in the ozonolysis of oleic acid. (2022 · Physical Chemistry, Chemical Physics - PCCP · 被引 12)