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Researcher
Ruben Goeminne
- Disciplines:Astronomy and space sciences, Other physical sciences, Classical physics, Elementary particle and high energy physics
Affiliations
- Department of Applied physics (Department)
Member
From1 Sep 2022 → Today - Department of Physics and astronomy (Department)
Member
From1 Sep 2018 → 24 Sep 2023
Publications
1 - 5 of 5
- Nuclear quantum effects on zeolite proton hopping kinetics explored with machine learning potentials and path integral molecular dynamics(2023)
Authors: Massimo Bocus, Ruben Goeminne, Aran Lamaire, Maarten Cools-Ceuppens, Toon Verstraelen
- DFT-quality adsorption simulations in metal-organic frameworks enabled by machine learning potentials(2023)
Authors: Ruben Goeminne, Louis Vanduyfhuys, Veronique Van Speybroeck, Toon Verstraelen
Pages: 6313 - 6325 - Accurately determining the phase transition temperature of CsPbI3 via random-phase approximation calculations and phase-transferable machine learning potentials(2022)
Authors: Tom Braeckevelt, Ruben Goeminne, Sander Vandenhaute, Sander Borgmans, Toon Verstraelen, Julian A. Steele, Maarten B. J. Roeffaers, Johan Hofkens, Sven Rogge
Pages: 8561 - 8576 - Charting the complete thermodynamic landscape of gas adsorption for a responsive metalU+2013organic framework(2021)
Authors: Ruben Goeminne, Simon Krause, Stefan Kaskel, Toon Verstraelen, Jack D. Evans
Pages: 4143 - 4147 - Modeling gas adsorption in flexible metal-organic frameworks via hybrid Monte Carlo/molecular dynamics schemes(2019)
Authors: Sven Rogge, Ruben Goeminne, Ruben Demuynck, Juan José Gutiérrez Sevillano, Steven Vandenbrande, Louis Vanduyfhuys, Michel Waroquier, Toon Verstraelen, Veronique Van Speybroeck