Scriptie
- 7 resultaten
Zoekresultaten
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Benchmarking Multiscale Model of Self-Healing Materials: Integrating ReaxFF based Molecular Dynamics for Covalent Adaptable Networks Development
Auteur: Vermeersch, L., De Vleeschouwer, F., Mangialetto, J. & Delvalle, K., 2025Scriptie/Masterproef: Master's Thesis
Bestand -
Computational DFT study and organic synthesis of QNO radical derivatives
Auteur: Hendrickx, A., Hennecke, U., De Vleeschouwer, F., Bertouille, J., Desmedt, E., De Proft, F. & Martin, C., jun. 2021Scriptie/Masterproef: Master's Thesis
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Designing stable and redox active radicals through the chemical compound space via a stochastic search
Auteur: Denayer, M., De Vleeschouwer, F., Teunissen, J., Hennecke, U. & Geerlings, P., sep. 2019Scriptie/Masterproef: Master's Thesis
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Frustrated Lewis Pairs: Rationalizing the Non-Covalent Interactions
Auteur: Top, J., Pinter, B. & De Vleeschouwer, F., 2014Scriptie/Masterproef: Master's Thesis
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Predicting global and local reactivity descriptors, the neural network approach
Auteur: Jacobs, M., De Vleeschouwer, F., Vermeersch, L., Geerlings, P. & Elskens, M., sep. 2022Scriptie/Masterproef: Master's Thesis
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The role of different types of noncovalent bonding as Lewis-type catalysts in three prototypical Diels-Alder reactions
Auteur: Faulkner, V., De Vleeschouwer, F., De Proft, F., Hennecke, U. & Alonso Giner, M., sep. 2019Scriptie/Masterproef: Master's Thesis
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Unravelling the conformational preference of the dienophile in the Diels-Alder reaction
Auteur: Vermeersch, L., de Smet, J., De Vleeschouwer, F. & Deraet, X., 2025Scriptie/Masterproef: Master's Thesis