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Author |
Title |
Year |
Publication |
Volume |
Times cited |
Additional Links |
Links |
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Larrain, M.; Van Passel, S.; Thomassen, G.; Kresovic, U.; Alderweireldt, N.; Moerman, E.; Billen, P. |
Economic performance of pyrolysis of mixed plastic waste: Open-loop versus closed-loop recycling |
2020 |
Journal Of Cleaner Production |
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UA library record; WoS full record; WoS citing articles |
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Sui, Y.; Jiang, Y.; Moretti, M.; Vlaeminck, S.E. |
Harvesting time and biomass composition affect the economics of microalgae production |
2020 |
Journal Of Cleaner Production |
259 |
5 |
UA library record; WoS full record; WoS citing articles |
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Buyle, M.; Maes, B.; Van Passel, S.; Boonen, K.; Vercalsteren, A.; Audenaert, A. |
Ex-ante LCA of emerging carbon steel slag treatment technologies : fast forwarding lab observations to industrial-scale production |
2021 |
Journal Of Cleaner Production |
313 |
|
UA library record; WoS full record |
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Azadi, H.; Moghaddam, S.M.; Burkart, S.; Mahmoudi, H.; Van Passel, S.; Kurban, A.; Lopez-Carr, D. |
Rethinking resilient agriculture : from Climate-Smart Agriculture to Vulnerable-Smart Agriculture |
2021 |
Journal Of Cleaner Production |
319 |
|
UA library record; WoS full record; WoS citing articles |
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Neyts, E.C.; Thijsse, B.J.; Mees, M.J.; Bal, K.M.; Pourtois, G. |
Establishing uniform acceptance in force biased Monte Carlo simulations |
2012 |
Journal of chemical theory and computation |
8 |
20 |
UA library record; WoS full record; WoS citing articles |
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Bal, K.M.; Neyts, E.C. |
Merging Metadynamics into Hyperdynamics: Accelerated Molecular Simulations Reaching Time Scales from Microseconds to Seconds |
2015 |
Journal of chemical theory and computation |
11 |
41 |
UA library record; WoS full record; WoS citing articles |
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Bal, K.M. |
Reweighted Jarzynski sampling : acceleration of rare events and free energy calculation with a bias potential learned from nonequilibrium work |
2021 |
Journal Of Chemical Theory And Computation |
17 |
|
UA library record; WoS full record; WoS citing articles |
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Martin, J.M.L.; François, J.P.; Gijbels, R. |
Ab initio study of the structure, infrared spectra and heat of formation of C4 |
1991 |
The journal of chemical physics |
94 |
62 |
UA library record; WoS full record; WoS citing articles |
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Taylor, P.R.; Martin, J.M.L.; François, J.P.; Gijbels, R. |
An ab initio study of the C3+ cation using multireference methods |
1991 |
The journal of chemical physics |
95 |
|
UA library record |
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Singh, S.K.; Neek-Amal, M.; Peeters, F.M. |
Electronic properties of graphene nano-flakes : energy gap, permanent dipole, termination effect, and Raman spectroscopy |
2014 |
The journal of chemical physics |
140 |
30 |
UA library record; WoS full record; WoS citing articles |
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Martin, J.M.L.; François, J.P.; Gijbels, R. |
First principles computation of thermo-chemical properties beyond the harmonic approximation: 1: method and application to the water molecule and its isotopomers |
1992 |
The journal of chemical physics |
96 |
59 |
UA library record; WoS full record; WoS citing articles |
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Martin, J.M.L.; François, J.P.; Gijbels, R. |
First principles computation of thermo-chemical properties beyond the harmonic approximation: 2: application to the amino radical and its isotopomers |
1992 |
The journal of chemical physics |
97 |
22 |
UA library record; WoS full record; WoS citing articles |
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Martin, J.M.L.; François, J.P.; Gijbels, R. |
On the effect of centrifugal stretching on the rotational partition function of an asymmetric top |
1991 |
The journal of chemical physics |
95 |
12 |
UA library record; WoS full record; WoS citing articles |
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Martin, J.M.L.; François, J.P.; Gijbels, R. |
On the heat formation of C8 and higher carbon clusters (letter to the editor) |
1991 |
The journal of chemical physics |
95 |
27 |
UA library record; WoS full record; WoS citing articles |
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Bal, K.M.; Neyts, E.C. |
On the time scale associated with Monte Carlo simulations |
2014 |
The journal of chemical physics |
141 |
26 |
UA library record; WoS full record; WoS citing articles |
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Euan-Diaz, E.; Herrera-Velarde, S.; Misko, V.R.; Peeters, F.M.; Castaneda-Priego, R. |
Structural transitions and long-time self-diffusion of interacting colloids confined by a parabolic potential |
2015 |
The journal of chemical physics |
142 |
7 |
UA library record; WoS full record; WoS citing articles |
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Michel, K.H.; Verberck, B.; Hulman, M.; Kuzmany, H.; Krause, M. |
Superposition of quantum and classical rotational motions in Sc2C2@C84 fullerite |
2007 |
The journal of chemical physics |
126 |
14 |
UA library record; WoS full record; WoS citing articles |
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Kandemir, A.; Peeters, F.M.; Sahin, H. |
Monitoring the effect of asymmetrical vertical strain on Janus single layers of MoSSe via spectrum |
2018 |
The journal of chemical physics |
149 |
11 |
UA library record; WoS full record; WoS citing articles |
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Bal, K.M.; Fukuhara, S.; Shibuta, Y.; Neyts, E.C. |
Free energy barriers from biased molecular dynamics simulations |
2020 |
Journal Of Chemical Physics |
153 |
|
UA library record; WoS full record; WoS citing articles |
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Baskurt, M.; Yagmurcukardes, M.; Peeters, F.M.; Sahin, H. |
Stable single-layers of calcium halides (CaX₂, X = F, Cl, Br, I) |
2020 |
Journal Of Chemical Physics |
152 |
14 |
UA library record; WoS full record; WoS citing articles |
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Payne, L.M.; Masia, F.; Zilli, A.; Albrecht, W.; Borri, P.; Langbein, W. |
Quantitative morphometric analysis of single gold nanoparticles by optical extinction microscopy: Material permittivity and surface damping effects |
2021 |
Journal Of Chemical Physics |
154 |
|
UA library record; WoS full record; WoS citing articles |
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Hamid, I.; Jalali, H.; Peeters, F.M.; Neek-Amal, M. |
Abnormal in-plane permittivity and ferroelectricity of confined water : from sub-nanometer channels to bulk |
2021 |
Journal Of Chemical Physics |
154 |
13 |
UA library record; WoS full record; WoS citing articles |
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Bal, K.M.; Neyts, E.C. |
Extending and validating bubble nucleation rate predictions in a Lennard-Jones fluid with enhanced sampling methods and transition state theory |
2022 |
Journal Of Chemical Physics |
157 |
|
UA library record; WoS full record; WoS citing articles |
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Bal, K.M. |
Nucleation rates from small scale atomistic simulations and transition state theory |
2021 |
Journal Of Chemical Physics |
155 |
|
UA library record; WoS full record; WoS citing articles |
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Oliveira, M.C.; Yusupov, M.; Bogaerts, A.; Cordeiro, R.M. |
Lipid Oxidation: Role of Membrane Phase-Separated Domains |
2021 |
Journal Of Chemical Information And Modeling |
61 |
|
UA library record; WoS full record; WoS citing articles |
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Ghasemitarei, M.; Privat-Maldonado, A.; Yusupov, M.; Rahnama, S.; Bogaerts, A.; Ejtehadi, M.R. |
Effect of Cysteine Oxidation in SARS-CoV-2 Receptor-Binding Domain on Its Interaction with Two Cell Receptors: Insights from Atomistic Simulations |
2022 |
Journal Of Chemical Information And Modeling |
62 |
|
UA library record; WoS full record; WoS citing articles |
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Verheyen, E.; Jo, C.; Kurttepeli, M.; Vanbutsele, G.; Gobechiya, E.; Korányi, T.I.; Bals, S.; Van Tendeloo, G.; Ryoo, R.; Kirschhock, C.E.A.; Martens, J.A.; |
Molecular shape-selectivity of MFI zeolite nanosheets in n-decane isomerization and hydrocracking |
2013 |
Journal of catalysis |
300 |
121 |
UA library record; WoS full record; WoS citing articles |
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Dams, M.; Drijkoningen, L.; Pauwels, B.; Van Tendeloo, G.; de Vos, D.E.; Jacobs, P.A. |
Pd-zeolites as heterogeneous catalysts in heck chemistry |
2002 |
Journal of catalysis |
209 |
157 |
UA library record; WoS full record; WoS citing articles |
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Philippaerts, A.; Paulussen, S.; Turner, S.; Lebedev, O.I.; Van Tendeloo, G.; Poelman, H.; Bulut, M.; de Clippel, F.; Smeets, P.; Sels, B.; Jacobs, P. |
Selectivity in sorption and hydrogenation of methyl oleate and elaidate on MFI zeolites |
2010 |
Journal of catalysis |
270 |
24 |
UA library record; WoS full record; WoS citing articles |
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Leus, K.; Liu, Y.-Y.; Meledina, M.; Turner, S.; Van Tendeloo, G.; van der Voort, P. |
A MoVI grafted metal organic framework : synthesis, characterization and catalytic investigations |
2014 |
Journal of catalysis |
316 |
36 |
UA library record; WoS full record; WoS citing articles |
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