Scott Habershon

28PUBLICATIONS
23CO-AUTHORS
Life historiesChemical thermodynamics and energeticsComputational chemistryComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Theoretical quantum chemistry
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Publications (28)

|Oct 22, 2026
A Simulation-Free Topological Basis for Building Compact Koopman Models of Protein Folding.

|Apr 08, 2026
Revisiting the Maximum Hardness Principle: A Quantitative Analysis on Reaction Datasets.

Ashima Bajaj, Farnaz Heidar-Zadeh, Thijs Stuyver

|Mar 13, 2026
Automated Discovery of Algorithms for Molecular Electronic Structure Calculations Using Physics-Informed Program Synthesis.

Kyle Acheson, Rastislav Turanyi, Scott Habershon

|Jul 10, 2025
Tethered Gaussian wavepackets for quantum dynamics simulations: Sticking together for better convergence.

Lidice Cruz-Rodriguez, Scott Habershon

|Dec 18, 2024
Exploring New Algorithms for Molecular Vibrational Spectroscopy Using Physics-Informed Program Synthesis.

Kyle Acheson, Scott Habershon

|Nov 08, 2024
Integrated computational and experimental design of fluorescent heteroatom-functionalised maleimide derivatives.

Jake E Barker, Gareth W Richings, Yujie Xie

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Frequent Collaborators

5 joint publications

Reinhard J Maurer

4 joint publications

James Gardner

3 joint publications

Christopher Robertson

3 joint publications

Gabriele C Sosso