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Tigany Zarrouk
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Experiment-Driven Atomistic Materials Modeling: A Case Study Combining X-Ray Photoelectron Spectroscopy and Machine Learning Potentials to Infer the Structure of Oxygen-Rich …
T Zarrouk, R Ibragimova, AP Bartók, MA Caro
Journal of the American Chemical Society, 2024
92024
Dynamic strain aging and the role of the Cottrell atmosphere
IH Katzarov, LB Drenchev, DL Pashov, T Zarrouk, O Al-Lahham, ...
Physical Review Materials 6 (6), 063603, 2022
32022
Accelerated First‐Principles Exploration of Structure and Reactivity in Graphene Oxide
Z El‐Machachi, D Frantzov, A Nijamudheen, T Zarrouk, MA Caro, ...
Angewandte Chemie International Edition 63 (52), e202410088, 2024
12024
Unifying the description of hydrocarbons and hydrogenated carbon materials with a chemically reactive machine learning interatomic potential
R Ibragimova, MS Kuklin, T Zarrouk, MA Caro
Chemistry of Materials, 2024
12024
Experiment-driven atomistic materials modeling: A case study combining XPS and ML potentials to infer the structure of oxygen-rich amorphous carbon
T Zarrouk, R Ibragimova, AP Bartók, MA Caro
arXiv preprint arXiv:2402.03219, 2024
12024
Simple quantum-mechanical models for defects in titanium and iron—how far can they take us?
T Zarrouk
King's College London, 2022
2022
Kinetic Monte Carlo Simulation of Screw Dislocations in Iron
O Al-lahham, T Paxton
2020
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