Jochen Autschbach

152PUBLICATIONS
377CO-AUTHORS
Chemical thermodynamics and energeticsMain group metal chemistryStructure and dynamics of materialsNanoelectronicsTheoretical quantum chemistry
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Publications (152)

|Jul 20, 2026
Theoretical Analysis of Low Energy Electronic Transitions of Actinide Complexes Including Spin-Orbit Effects.

|Jun 18, 2026
Synthesis of a Series of Ln(III) (Ln = La, Ce, Lu) Aryl Complexes and Analysis of Their Ln-L Bonding Using Multinuclear NMR Spectroscopy and DFT Calculations.

|May 18, 2026
Comparison of Bonding in Isostructural Cerium and Thorium Parent Amide Complexes.

|Apr 15, 2026
Elucidating metal (Zr, Hf, Th, U)-hydride covalency using 1H NMR chemical shifts and density functional calculations.

|Mar 23, 2026
Leveraging the redox activities of cerium and dibenzotetrathiafulvalene to discover a photo-responsive magnetic material.

Himanshu Gupta, Ethan P Shapera, Xiaojuan Yu

|Feb 17, 2026
Effects of Structure and Bonding on 195Pt Magnetic Shielding Tensors: Insights from Relativistic DFT and Localized Molecular Orbital Analysis.

Sean T Holmes, Adam B Philips, Alberto Fernández-Alarcón

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Frequent Collaborators

27 joint publications

Dumitru-Claudiu Sergentu

24 joint publications

Jeanne Crassous

21 joint publications

Xiaojuan Yu

16 joint publications

Laura Abella