Kamu erişimi zorunlu olan makaleler - Thijs VlugtDaha fazla bilgi edinin
Hiçbir yerde sunulmuyor: 11
On the mechanism behind the instability of isoreticular metal–organic frameworks (irmofs) in humid environments
L Bellarosa, JM Castillo, T Vlugt, S Calero, N López
Chemistry–A European Journal 18 (39), 12260-12266, 2012
Zorunlu olanlar: Government of Spain
Direct free energy calculation in the Continuous Fractional Component Gibbs ensemble
A Poursaeidesfahani, A Torres-Knoop, D Dubbeldam, TJH Vlugt
Journal of chemical theory and computation 12 (4), 1481-1490, 2016
Zorunlu olanlar: Netherlands Organisation for Scientific Research
Assessing the surface area of porous solids: limitations, probe molecules, and methods
MF De Lange, LC Lin, J Gascon, TJH Vlugt, F Kapteijn
Langmuir 32 (48), 12664-12675, 2016
Zorunlu olanlar: Netherlands Organisation for Scientific Research
CO2 stripping from ionic liquid at elevated pressures in gas-liquid membrane contactor
S Bazhenov, A Malakhov, D Bakhtin, V Khotimskiy, G Bondarenko, ...
International Journal of Greenhouse Gas Control 71, 293-302, 2018
Zorunlu olanlar: Netherlands Organisation for Scientific Research
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
Zorunlu olanlar: Netherlands Organisation for Scientific Research
Strategies to simultaneously enhance the hydrostability and the alcohol–water separation behavior of Cu-BTC
JJ Gutierrez-Sevillano, D Dubbeldam, L Bellarosa, N Lopez, X Liu, ...
The Journal of Physical Chemistry C 117 (40), 20706-20714, 2013
Zorunlu olanlar: Government of Spain
Computation of the heat and entropy of adsorption in proximity of inflection points
A Poursaeidesfahani, A Torres-Knoop, M Rigutto, N Nair, D Dubbeldam, ...
The Journal of Physical Chemistry C 120 (3), 1727-1738, 2016
Zorunlu olanlar: Netherlands Organisation for Scientific Research
Exploring new methods and materials for enantioselective separations and catalysis
D Dubbeldam, S Calero, TJH Vlugt
Molecular Simulation 40 (7-9), 585-598, 2014
Zorunlu olanlar: European Commission
Optimization of particle transfers in the Gibbs ensemble for systems with strong and directional interactions using CBMC, CFCMC, and CB/CFCMC
A Torres-Knoop, NC Burtch, A Poursaeidesfahani, SP Balaji, R Kools, ...
The Journal of Physical Chemistry C 120 (17), 9148-9159, 2016
Zorunlu olanlar: US National Science Foundation, US Department of Energy, Netherlands …
CO2 solubility in small carboxylic acids: Monte Carlo simulations and PC-SAFT modeling
M Ramdin, SH Jamali, LJP van den Broeke, W Buijs, TJH Vlugt
Fluid Phase Equilibria 458, 1-8, 2018
Zorunlu olanlar: Netherlands Organisation for Scientific Research
Molecular simulations of adsorption and diffusion in crystalline nanoporous materials
D Dubbeldam, S Calero, TJH Vlugt, RQ Snurr
HANDBOOK OF POROUS MATERIALS: Synthesis, Properties, Modeling and Key …, 2021
Zorunlu olanlar: US Department of Energy, Netherlands Organisation for Scientific Research …
Bir yerde sunuluyor: 152
iRASPA: GPU-accelerated visualization software for materials scientists
D Dubbeldam, S Calero, TJH Vlugt
Molecular Simulation 44 (8), 653-676, 2018
Zorunlu olanlar: Netherlands Organisation for Scientific Research
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
Zorunlu olanlar: Netherlands Organisation for Scientific Research
High Pressure Electrochemical Reduction of CO2 to Formic Acid/Formate: A Comparison between Bipolar Membranes and Cation Exchange Membranes
M Ramdin, ART Morrison, M de Groen, R van Haperen, R De Kler, ...
Industrial & engineering chemistry research 58 (5), 1834-1847, 2019
Zorunlu olanlar: Netherlands Organisation for Scientific Research
High-Pressure Electrochemical Reduction of CO2 to Formic Acid/Formate: Effect of pH on the Downstream Separation Process and Economics
M Ramdin, ART Morrison, M De Groen, R Van Haperen, R De Kler, ...
Industrial & Engineering Chemistry Research 58 (51), 22718-22740, 2019
Zorunlu olanlar: Netherlands Organisation for Scientific Research
Finite-size effects of diffusion coefficients computed from molecular dynamics: a review of what we have learned so far
AT Celebi, SH Jamali, A Bardow, TJH Vlugt, OA Moultos
Molecular Simulation 47 (10-11), 831-845, 2021
Zorunlu olanlar: Netherlands Organisation for Scientific Research
Mechanical instability of monocrystalline and polycrystalline methane hydrates
J Wu, F Ning, TT Trinh, S Kjelstrup, TJH Vlugt, J He, BH Skallerud, ...
Nature Communications 6 (1), 8743, 2015
Zorunlu olanlar: National Natural Science Foundation of China, Research Council of Norway
Compressibility, thermal expansion coefficient and heat capacity of CH 4 and CO 2 hydrate mixtures using molecular dynamics simulations
FL Ning, K Glavatskiy, Z Ji, S Kjelstrup, TJH Vlugt
Physical Chemistry Chemical Physics 17 (4), 2869-2883, 2015
Zorunlu olanlar: National Natural Science Foundation of China
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
Zorunlu olanlar: Netherlands Organisation for Scientific Research
Structural, thermodynamic, and transport properties of aqueous reline and ethaline solutions from molecular dynamics simulations
AT Celebi, TJH Vlugt, OA Moultos
The Journal of Physical Chemistry B 123 (51), 11014-11025, 2019
Zorunlu olanlar: Netherlands Organisation for Scientific Research
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