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Publications (305)
- Vibrational Spectra, Conformations, and Optical Rotation of Aqueous Amino Acids: Zwitterions of L‐Alanine and L‐Valine Save
- Aldehyde (α-Methoxy)allylation via 2-Propanol-Mediated Reductive Coupling: Halide-Dependent Regio- and Enantioselection from 1 of 24 Fluxional Diastereomeric-at-Ruthenium-SEGPHOS Complexes Save
- The rocky path of DFT into chemistry—Discussions at a symposium and reflections on a circular journey in honor of Axel Becke 1953–2025 Save
- q-vSZPs: A polarized, adaptive minimal Gaussian basis set for the elements Z = 1–86 designed for efficient mean-field electronic structure calculations Save
- From Sequential Molecular Adsorption on Atomically Precise Ag29 Nanoclusters to Aggregates of Soot-Like Particles Save
- A Ruthenium‐(Ph‐BPE) Catalyst for Asymmetric Alkynylation of Fluoral: Enantioselection From 1 of 12 Fluxional Stereogenic‐at‐Ruthenium Complexes Save
- Ein Ruthenium‐(Ph‐BPE) Katalysator für die asymmetrische Alkinylierung von Fluoral: Enantioselektion aus einem von 12 fluxionalen Komplexen mit rutheniumzentrierter Stereogenität Save
- An element-resolved coupled cluster atomization energy data set ranging across the periodic table Save
- A Molecular “Thermometer” for Measuring Effective Non‐Local Exchange Save
- q-vSZPs: A polarized, adaptive minimal Gaussian basis set for the elements Z = 1−86 designed for efficient mean-field electronic structure calculations Save