Andreas Hansen

57PUBLICATIONS
104CO-AUTHORS
Condensed matter modelling and density functional theoryMain group metal chemistryTransport properties and non-equilibrium processesComputational complexity and computabilityCatalysis and mechanisms of reactions
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Publications (57)

|Oct 27, 2026
An element-resolved coupled cluster atomization energy data set ranging across the periodic table.

|Jun 26, 2026
Steric Mapping, Ligand Dynamics, and Cycloisomerization Catalysis with Redox Robust MnI/0/‑I Dicarbenes.

|Jun 23, 2026
A Molecular "Thermometer" for Measuring Effective Non-Local Exchange.

|Oct 06, 2025
Expanding the PCET Thermochemistry of CpN3: N-H Bond Strengths of Metal-Free CpN3 Molecules and the Influence of Fe(CO)3 Coordination.

David S Tresp, Tim K Schramm, Sanju Luhach

|Oct 02, 2025
Submatrix and GPU-accelerated implementation of density matrix tight-binding.

Abylay Katbashev, Robert Schade, Michael Lass

|Sep 09, 2025
A 100,000-Fold Increase in C-H Bond Acidity Gives Palladium a Key Advantage in C(sp3)-H Activation Compared to Nickel.

Lirong Lin, Tim K Schramm, Pavel Kucheryavy

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Frequent Collaborators

46 joint publications

Stefan Grimme

12 joint publications

Markus Bursch

9 joint publications

Marcel Müller

5 joint publications

Jan-Michael Mewes