| Solubility of the Precombustion Gases CO2, CH4, CO, H2, N2, and H2S in the Ionic Liquid [bmim][Tf2N] from Monte Carlo Simulations M Ramdin, SP Balaji, JM Vicent-Luna, JJ Gutiérrez-Sevillano, S Calero, ... The Journal of Physical Chemistry C 118 (41), 23599-23604, 2014 | 80 | 2014 |
| A comparison of advanced Monte Carlo methods for open systems: CFCMC vs CBMC A Torres-Knoop, SP Balaji, TJH Vlugt, D Dubbeldam Journal of chemical theory and computation 10 (3), 942-952, 2014 | 79 | 2014 |
| How to apply the Kirkwood–Buff theory to individual species in salt solutions SK Schnell, P Englebienne, JM Simon, P Krüger, SP Balaji, S Kjelstrup, ... Chemical Physics Letters 582, 154-157, 2013 | 63 | 2013 |
| Surface barriers of hydrocarbon transport triggered by ideal zeolite structures NER Zimmermann, SP Balaji, FJ Keil The Journal of Physical Chemistry C 116 (5), 3677-3683, 2012 | 47 | 2012 |
| Solubilities of CO2, CH4, C2H6, and SO2 in ionic liquids and Selexol from Monte Carlo simulations M Ramdin, Q Chen, SP Balaji, JM Vicent-Luna, A Torres-Knoop, ... Journal of Computational Science 15, 74-80, 2016 | 40 | 2016 |
| Simulating the Reactions of CO2 in Aqueous Monoethanolamine Solution by Reaction Ensemble Monte Carlo Using the Continuous Fractional Component Method SP Balaji, S Gangarapu, M Ramdin, A Torres-Knoop, H Zuilhof, ... Journal of chemical theory and computation 11 (6), 2661-2669, 2015 | 38 | 2015 |
| Validation of the CO2/N2O Analogy Using Molecular Simulation Q Chen, SP Balaji, M Ramdin, JJ Gutiérrez-Sevillano, A Bardow, ... Industrial & Engineering Chemistry Research 53 (46), 18081-18090, 2014 | 37 | 2014 |
| Solubility of natural gas species in ionic liquids and commercial solvents: experiments and Monte Carlo simulations M Ramdin, SP Balaji, A Torres-Knoop, D Dubbeldam, TW de Loos, ... Journal of Chemical & Engineering Data 60 (10), 3039-3045, 2015 | 32 | 2015 |
| Theoretical investigation of the mechanism of the selective catalytic reduction of nitrogen dioxide with ammonia on H-form zeolites and the role of nitric and nitrous acids as … TC Brüggemann, MD Przybylski, SP Balaji, FJ Keil The Journal of Physical Chemistry C 114 (14), 6567-6587, 2010 | 27 | 2010 |
| A direct method for calculating thermodynamic factors for liquid mixtures using the Permuted Widom test particle insertion method SP Balaji, SK Schnell, ES McGarrity, TJH Vlugt Molecular Physics 111 (2), 287-296, 2013 | 23 | 2013 |
| 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 | 22 | 2016 |
| Computing bubble-points of CO2/CH4 gas mixtures in ionic liquids from Monte Carlo simulations M Ramdin, SP Balaji, JM Vicent-Luna, A Torres-Knoop, Q Chen, ... Fluid Phase Equilibria 418, 100-107, 2016 | 12 | 2016 |
| Calculating thermodynamic factors of ternary and multicomponent mixtures using the Permuted Widom test particle insertion method SP Balaji, SK Schnell, TJH Vlugt Theoretical Chemistry Accounts 132, 1-8, 2013 | 11 | 2013 |
| Flexible process for converting carbon dioxide, hydrogen, and methane into synthesis gas SP Balaji, M Klokkenburg, R Schouwenaar, DJM Unruh, JAQ ENRIQUEZ US Patent App. 17/922,483, 2023 | | 2023 |
| A process and reactor for converting carbon dioxide into carbon monoxide, involving a catalyst SP Balaji, M Klokkenburg, R Schouwenaar, DJM Unruh, JAQ ENRIQUEZ, ... US Patent App. 17/925,488, 2023 | | 2023 |
| A process and reactor for converting carbon dioxide into carbon monoxide SP Balaji, M Klokkenburg, R Schouwenaar, JAQ ENRIQUEZ US Patent App. 17/299,425, 2022 | | 2022 |
| Absorption of Greenhouse Gases in Liquids: A Molecular Approach SP Balaji | | 2015 |
| Modeling the absorption of carbon dioxide in amines SP Balaji, TJH Vlugt NPS-11, 2011 | | 2011 |
| Supporting Information for: Simulating the reactions of CO2 in aqueous monoethanolamine solution by Reaction Ensemble Monte Carlo using the Continuous Fractional Component method SP Balaji, S Gangarapu, M Ramdin, A Torres-Knoop, H Zuilhof, ... | | |
| Supporting Information for: Validation of the CO2/N2O Analogy using Molecular Simulation Q Chen, SP Balaji, M Ramdin, J José | | |
Thijs VlugtProfessor and Chair Engineering ThermodynamicsVerified email at tudelft.nl
