Ghent University Academic Bibliography

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Classical force field parameters for InP and InAs quantum dots with various surface passivations

Kim Corinna Dümbgen (UGent) , Roberta Pascazio, Bas van Beek, Zeger Hens (UGent) and Ivan Infante

(2023) JOURNAL OF PHYSICAL CHEMISTRY A. 127(15). p.3427-3436
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- Miscellaneous
Memorial viewpoint for Joop van Lenthe

Gabriel G. Balint-Kurti, Ria Broer, Peter H. M. Budzelaar, Hubertus J. J. van Dam, Fokke Dijkstra, Henk Eshuis, Gerrit C. Groenenboom, Martyn F. Guest, Remco Havenith (UGent) , Anthony J. H. M. Meijer, et al.

(2022) JOURNAL OF PHYSICAL CHEMISTRY A. 126(41). p.7415-7417
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- Journal Article
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Learning molecular representations for thermochemistry prediction of cyclic hydrocarbons and oxygenates

Maarten Dobbelaere (UGent) , Pieter Plehiers, Ruben Van de Vijver (UGent) , Christian Stevens (UGent) and Kevin Van Geem (UGent)

(2021) JOURNAL OF PHYSICAL CHEMISTRY A. 125(23). p.5166-5179
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Periodoannulenes : a generalized annulene-within-an-annulene paradigm for combined sigma and pi ring currents

Patrick W. Fowler and Remco Havenith (UGent)

(2021) JOURNAL OF PHYSICAL CHEMISTRY A. 125(29). p.6374-6383
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Optical properties of isolated and covalent organic framework-embedded ruthenium complexes

Francesco Muniz Miranda (UGent) , Liesbeth De Bruecker (UGent) , Arthur De Vos, Flore Vanden Bussche, Christian Stevens (UGent) , Pascal Van Der Voort (UGent) , Kurt Lejaeghere (UGent) and Veronique Van Speybroeck (UGent)

(2019) JOURNAL OF PHYSICAL CHEMISTRY A. 123(32). p.6854-6867
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Rate/concentration kinetic petals : a transient method to examine the interplay of surface reaction processes

Yixiao Wang, M. Ross Kunz, Denis Constales (UGent) , Gregory Yablonsky and Rebecca Fushimi

(2019) JOURNAL OF PHYSICAL CHEMISTRY A. 123(40). p.8717-8725
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Information-theoretic approaches to atoms-in-molecules : Hirshfeld family of partitioning schemes

Farnaz Heidar-Zadeh, Paul W Ayers, Toon Verstraelen (UGent) , Ivan Vinogradov, Esteban Vohringer-Martinez and Patrick Bultinck (UGent)

(2018) JOURNAL OF PHYSICAL CHEMISTRY A. 122(17). p.4219-4245
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ENDOR-induced EPR of disordered systems : application to X-irradiated alanine

Jevgenij Kusakovskij (UGent) , Kwinten Maes, Freddy Callens (UGent) and Henk Vrielinck (UGent)

(2018) JOURNAL OF PHYSICAL CHEMISTRY A. 122(6). p.1756-1763
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Can the dielectric constant of fullerene derivatives be enhanced by side-chain manipulation? : a predictive first-principles computational study

Selim Sami, Pi A. B. Haase, Riccardo Alessandri, Ria Broer and Remco Havenith (UGent)

(2018) JOURNAL OF PHYSICAL CHEMISTRY A. 122(15). p.3919-3926
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- Miscellaneous
4th International conference on chemical bonding

Jesus M Ugalde, Patrick Bultinck (UGent) , F Matthias Bickelhaupt and Anastassia N Alexandrova

(2016) JOURNAL OF PHYSICAL CHEMISTRY A. 120(47). p.9353-9356

Academic Bibliography

Classical force field parameters for InP and InAs quantum dots with various surface passivations

Memorial viewpoint for Joop van Lenthe

Learning molecular representations for thermochemistry prediction of cyclic hydrocarbons and oxygenates

Periodoannulenes : a generalized annulene-within-an-annulene paradigm for combined sigma and pi ring currents

Optical properties of isolated and covalent organic framework-embedded ruthenium complexes

Rate/concentration kinetic petals : a transient method to examine the interplay of surface reaction processes

Information-theoretic approaches to atoms-in-molecules : Hirshfeld family of partitioning schemes

ENDOR-induced EPR of disordered systems : application to X-irradiated alanine

Can the dielectric constant of fullerene derivatives be enhanced by side-chain manipulation? : a predictive first-principles computational study

4th International conference on chemical bonding

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