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Tim M. Becker
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Finite-size effects of binary mutual diffusion coefficients from molecular dynamics
SH Jamali, L Wolff, TM Becker, A Bardow, TJH Vlugt, OA Moultos
Journal of chemical theory and computation 14 (5), 2667-2677, 2018
1392018
Polarizable Force Fields for CO2 and CH4 Adsorption in M-MOF-74
TM Becker, J Heinen, D Dubbeldam, LC Lin, TJH Vlugt
The Journal of Physical Chemistry C 121 (8), 4659-4673, 2017
972017
Impact of MOF defects on the binary adsorption of CO2 and water in UiO-66
MI Hossain, JD Cunningham, TM Becker, BE Grabicka, KS Walton, ...
Chemical Engineering Science 203, 346-357, 2019
872019
OCTP: A Tool for On-the-Fly Calculation of Transport Properties of Fluids with the Order-n Algorithm in LAMMPS
SH Jamali, L Wolff, TM Becker, M De Groen, M Ramdin, R Hartkamp, ...
Journal of chemical information and modeling 59 (4), 1290-1294, 2019
712019
Ammonia/ionic liquid based double-effect vapor absorption refrigeration cycles driven by waste heat for cooling in fishing vessels
W Meng, B Tim, M., S Bob, A., V Thijs, J., H., IF Carlos, A.
Energy Conversion and Management 174, 824-843, 2018
512018
Absorption refrigeration cycles with ammonia–ionic liquid working pairs studied by molecular simulation
TM Becker, M Wang, A Kabra, SH Jamali, M Ramdin, D Dubbeldam, ...
Industrial & engineering chemistry research 57 (15), 5442-5452, 2018
412018
Assessment of vapor–liquid equilibrium models for ionic liquid based working pairs in absorption cycles
M Wang, TM Becker, CAI Ferreira
International Journal of Refrigeration 87, 10-25, 2018
402018
Solubility of sulfur compounds in commercial physical solvents and an ionic liquid from Monte Carlo simulations
SH Jamali, M Ramdin, TM Becker, A Torres-Knoop, D Dubbeldam, ...
Fluid Phase Equilibria 433, 50-55, 2017
332017
Polarizable Force Field for CO2 in M-MOF-74 Derived from Quantum Mechanics
TM Becker, LC Lin, D Dubbeldam, TJH Vlugt
The Journal of Physical Chemistry C 122 (42), 24488-24498, 2018
312018
Investigating polarization effects of CO2 adsorption in MgMOF-74
TM Becker, D Dubbeldam, LC Lin, TJH Vlugt
Journal of Computational Science 15, 86-94, 2016
312016
Prediction of composition-dependent self-diffusion coefficients in binary liquid mixtures: The missing link for darken-based models
L Wolff, SH Jamali, TM Becker, OA Moultos, TJH Vlugt, A Bardow
Industrial & Engineering Chemistry Research 57 (43), 14784-14794, 2018
272018
Effective Model for Olefin/Paraffin Separation using (Co, Fe, Mn, Ni)‐MOF‐74
A Luna‐Triguero, JM Vicent‐Luna, TM Becker, TJH Vlugt, D Dubbeldam, ...
ChemistrySelect 2 (2), 665-672, 2017
232017
Potential of polarizable force fields for predicting the separation performance of small hydrocarbons in M-MOF-74
TM Becker, A Luna-Triguero, JM Vicent-Luna, LC Lin, D Dubbeldam, ...
Physical Chemistry Chemical Physics 20 (45), 28848-28859, 2018
192018
Thermodynamic and transport properties of crown-ethers: Force field development and molecular simulations
SH Jamali, M Ramdin, TM Becker, SK Rinwa, W Buijs, TJH Vlugt
The Journal of Physical Chemistry B 121 (35), 8367-8376, 2017
192017
Gibbs ensemble Monte Carlo simulations of multicomponent natural gas mixtures
M Ramdin, SH Jamali, TM Becker, TJH Vlugt
Molecular Simulation 44 (5), 377-383, 2018
132018
Computing equation of state parameters of gases from Monte Carlo simulations
M Ramdin, TM Becker, SH Jamali, M Wang, TJH Vlugt
Fluid Phase Equilibria 428, 174-181, 2016
112016
Molecular simulation of tunable materials: Metal-organic frameworks & ionic liquids theory & application
T Becker
Delft University of Technology, 2019
32019
Ionic liquid-ammonia double-effect absorption refrigeration cycles for refrigeration in fishing vessels
M Wang, TM Becker, CAI Ferreira
13th IIR Gustav Lorentzen Conference on Natural Refrigerants: Natural …, 2018
2018
Binary Adsorption of CO2 and Water on Uio-66 MOF
J Cunningham, MI Hossain, T Becker, B Rabideau, TG Glover
2017 AIChE Annual Meeting, 2017
2017
Multiscale Modeling of the Dissolution of Cellulose Bundles
AE Ismail, BD Rabideau, A Agarwal, TM Becker, T Ploch
Chemie Ingenieur Technik 86 (9), 1616-1616, 2014
2014
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Articles 1–20