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Naji, M. |
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Motta, Antonella |
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Aletan, Dirar |
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Mohamed, Tarek |
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Ertürk, Emre |
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Taccardi, Nicola |
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Kononenko, Denys |
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Petrov, R. H. | Madrid |
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Alshaaer, Mazen | Brussels |
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Bih, L. |
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Casati, R. |
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Muller, Hermance |
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Kočí, Jan | Prague |
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Šuljagić, Marija |
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Kalteremidou, Kalliopi-Artemi | Brussels |
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Azam, Siraj |
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Ospanova, Alyiya |
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Blanpain, Bart |
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Ali, M. A. |
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Popa, V. |
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Rančić, M. |
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Ollier, Nadège |
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Azevedo, Nuno Monteiro |
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Landes, Michael |
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Rignanese, Gian-Marco |
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Verstraelen, Toon
in Cooperation with on an Cooperation-Score of 37%
Topics
Publications (7/7 displayed)
- 2023DFT-quality adsorption simulations in metal-organic frameworks enabled by machine learning potentialscitations
- 2022Accurately determining the phase transition temperature of CsPbI3 via random-phase approximation calculations and phase-transferable machine learning potentialscitations
- 2021Charting the Complete Thermodynamic Landscape of Gas Adsorption for a Responsive Metal-Organic Frameworkcitations
- 2019Modeling gas adsorption in flexible metal-organic frameworks via hybrid Monte Carlo/molecular dynamics schemescitations
- 2017Methane adsorption in Zr-based MOFs : comparison and critical evaluation of force fieldscitations
- 2013New Functionalized Metal-Organic Frameworks MIL-47-X (X = -Cl, -Br, -CH3, -CF3, -OH, -OCH3)citations
- 2010Insights on the adsorption behavior of aromatics in MIL-47 and MIL-53 from a theoretical perspective
Places of action
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