David J Wales

87PUBLICATIONS
125CO-AUTHORS
Chemical thermodynamics and energeticsMultiphysics flows (incl. multiphase and reacting flows)Computational chemistryEvolutionary impacts of climate changeChemical and thermal processes in energy and combustion
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Publications (87)

|Oct 23, 2026
An Energy Landscape for Elemental Carbon.

|Oct 23, 2026
The AML-Associated A338V Mutation Rewires GPR183 Signaling through C-Terminal Ensemble Redistribution.

|Oct 23, 2026
Efficient searches for low-energy structures in clusters with thousands of particles: Application to the Thomson problem.

|Aug 13, 2026
Quantum Enhancement of Microcanonical Negative Heat Capacity Features in the Melting of Water Clusters.

|Aug 06, 2026
Evolution of the energy landscape for n-alkanes: n-C14H30 to n-C20H42.

|May 20, 2026
Accelerated Reaction Exploration across Scales: A Hybrid Operando and Modeling Study of Oxidation Kinetics in Monolayer Tungsten Disulfide.

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Frequent Collaborators

10 joint publications

Konstantin Röder

7 joint publications

Debayan Chakraborty

6 joint publications

Patryk Adam Wesołowski

5 joint publications

Philipp Pracht