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Roadmap on Data-Centric Materials Science

2024-02-01 | Preprint
Contributors: Stefan Bauer; Peter Benner; Tristan Bereau; Volker Blum; Mario Boley; Christian Carbogno; C. Richard A. Catlow; Gerhard Dehm; Sebastian Eibl; Ralph Ernstorfer et al.
Source: Self-asserted source
Igor Kowalec

Investigation of the Pd(1−x)Zn x alloy phase diagram using ab initio modelling approaches

Journal of Physics: Condensed Matter
2023-10-09 | Journal article
Contributors: Lara Kabalan; Igor Kowalec; Santiago Rigamonti; Maria Troppenz; Claudia Draxl; C Richard A Catlow; Andrew J Logsdail
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A computational study of direct CO2 hydrogenation to methanol on Pd surfaces

Physical Chemistry Chemical Physics
2022 | Journal article
Contributors: Igor Kowalec; Lara Kabalan; C. Richard A. Catlow; Andrew J. Logsdail
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Heterogeneous Trimetallic Nanoparticles as Catalysts

Chemical Reviews
2022-03-09 | Journal article
Part of ISSN: 0009-2665
Part of ISSN: 1520-6890
Source: Self-asserted source
Igor Kowalec

A computational study of the properties of low- and high-index Pd, Cu and Zn surfaces

Physical Chemistry Chemical Physics
2021 | Journal article
Contributors: Lara Kabalan; Igor Kowalec; C. Richard A. Catlow; Andrew J. Logsdail
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