Folgen
Ahmadreza Rahbari
Ahmadreza Rahbari
Bestätigte E-Mail-Adresse bei tudelft.nl
Titel
Zitiert von
Zitiert von
Jahr
Efficient application of Continuous Fractional Component Monte Carlo in the reaction ensemble
A Poursaeidesfahani, R Hens, A Rahbari, M Ramdin, D Dubbeldam, ...
Journal of chemical theory and computation 13 (9), 4452-4466, 2017
352017
Combined Steam Reforming of Methane and Formic Acid To Produce Syngas with an Adjustable H2:CO Ratio
A Rahbari, M Ramdin, LJP Van Den Broeke, TJH Vlugt
Industrial & engineering chemistry research 57 (31), 10663-10674, 2018
322018
Computation of thermodynamic properties in the continuous fractional component Monte Carlo Gibbs ensemble
A Poursaeidesfahani, A Rahbari, A Torres-Knoop, D Dubbeldam, ...
Molecular Simulation 43 (3), 189-195, 2017
282017
Solubility of water in hydrogen at high pressures: a molecular simulation study
A Rahbari, J Brenkman, R Hens, M Ramdin, LJP Van Den Broeke, ...
Journal of Chemical & Engineering Data 64 (9), 4103-4115, 2019
252019
Computation of partial molar properties using continuous fractional component Monte Carlo
A Rahbari, R Hens, IK Nikolaidis, A Poursaeidesfahani, M Ramdin, ...
Molecular Physics 116 (21-22), 3331-3344, 2018
232018
Adsorption equilibrium of nitrogen dioxide in porous materials
I Matito-Martos, A Rahbari, A Martin-Calvo, D Dubbeldam, TJH Vlugt, ...
Physical Chemistry Chemical Physics 20 (6), 4189-4199, 2018
192018
Recent advances in the continuous fractional component Monte Carlo methodology
A Rahbari, R Hens, M Ramdin, OA Moultos, D Dubbeldam, TJH Vlugt
Molecular Simulation 47 (10-11), 804-823, 2021
172021
Brick-CFCMC: Open source software for Monte Carlo simulations of phase and reaction equilibria using the Continuous Fractional Component Method
R Hens, A Rahbari, S Caro-Ortiz, N Dawass, M Erdős, ...
Journal of chemical information and modeling 60 (6), 2678-2682, 2020
172020
Chemical potentials of water, methanol, carbon dioxide and hydrogen sulphide at low temperatures using continuous fractional component Gibbs ensemble Monte Carlo
A Rahbari, A Poursaeidesfahani, A Torres-Knoop, D Dubbeldam, ...
Molecular Simulation 44 (5), 405-414, 2018
172018
Improving the accuracy of computing chemical potentials in CFCMC simulations
A Rahbari, R Hens, D Dubbeldam, TJH Vlugt
Molecular Physics 117 (23-24), 3493-3508, 2019
112019
Multiple linear regression and thermodynamic fluctuations are equivalent for computing thermodynamic derivatives from molecular simulation
A Rahbari, TR Josephson, Y Sun, OA Moultos, D Dubbeldam, ...
Fluid Phase Equilibria 523, 112785, 2020
92020
Effect of truncating electrostatic interactions on predicting thermodynamic properties of water–methanol systems
A Rahbari, R Hens, SH Jamali, M Ramdin, D Dubbeldam, TJH Vlugt
Molecular Simulation 45 (4-5), 336-350, 2019
92019
Multiple free energy calculations from single state point continuous fractional component Monte Carlo simulation using umbrella sampling
A Rahbari, R Hens, OA Moultos, D Dubbeldam, TJH Vlugt
Journal of chemical theory and computation 16 (3), 1757-1767, 2020
72020
Effect of water content on thermodynamic properties of compressed hydrogen
A Rahbari, JC Garcia-Navarro, M Ramdin, LJP Van Den Broeke, ...
Journal of Chemical & Engineering Data 66 (5), 2071-2087, 2021
52021
New features of the open source Monte Carlo software Brick-CFCMC: Thermodynamic integration and hybrid trial moves
HM Polat, HS Salehi, R Hens, DO Wasik, A Rahbari, F De Meyer, ...
Journal of chemical information and modeling 61 (8), 3752-3757, 2021
42021
Thermodynamics of Industrially Relevant Systems: Method Development and Applications
A Rahbari
Delft University of Technology, 2020
22020
Electro-osmotic Drag and Thermodynamic Properties of Water in Hydrated Nafion Membranes from Molecular Dynamics
A Rahbari, R Hartkamp, OA Moultos, A Bos, LJP van den Broeke, ...
The Journal of Physical Chemistry C, 2022
2022
Supporting Information Effect of water content on thermodynamic properties of compressed hydrogen
A Rahbari, JC Garcia-Navarro, M Ramdin, LJP van den Broeke, ...
Brick-CFCMC
R Hens, A Rahbari, S Caro-Ortiz, N Dawass, M Erdős, ...
Das System kann den Vorgang jetzt nicht ausführen. Versuchen Sie es später erneut.
Artikel 1–19