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Sondre K. Schnell
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Cooperative insertion of CO2 in diamine-appended metal-organic frameworks
TM McDonald, JA Mason, X Kong, ED Bloch, D Gygi, A Dani, V Crocellŕ, ...
Nature 519 (7543), 303-308, 2015
12352015
What are the best materials to separate a xenon/krypton mixture?
CM Simon, R Mercado, SK Schnell, B Smit, M Haranczyk
Chemistry of Materials 27 (12), 4459-4475, 2015
2762015
Kirkwood–Buff integrals for finite volumes
P Krüger, SK Schnell, D Bedeaux, S Kjelstrup, TJH Vlugt, JM Simon
J. Phys. Chem. Lett 4 (2), 235-238, 2013
2202013
Calculating thermodynamic properties from fluctuations at small scales
SK Schnell, X Liu, JM Simon, A Bardow, D Bedeaux, TJH Vlugt, ...
The Journal of Physical Chemistry B 115 (37), 10911-10918, 2011
1452011
Diffusion coefficients from molecular dynamics simulations in binary and ternary mixtures
X Liu, SK Schnell, JM Simon, P Krüger, D Bedeaux, S Kjelstrup, A Bardow, ...
International Journal of Thermophysics 34 (7), 1169-1196, 2013
1322013
Fick diffusion coefficients in ternary liquid systems from equilibrium molecular dynamics simulations
X Liu, A Martín-Calvo, E McGarrity, SK Schnell, S Calero, JM Simon, ...
Industrial & Engineering Chemistry Research 51 (30), 10247-10258, 2012
1172012
Fick diffusion coefficients of liquid mixtures directly obtained from equilibrium molecular dynamics
X Liu, SK Schnell, JM Simon, D Bedeaux, S Kjelstrup, A Bardow, ...
The Journal of Physical Chemistry B 115 (44), 12921-12929, 2011
1002011
Thermodynamics of a small system in a μT reservoir
SK Schnell, TJH Vlugt, JM Simon, D Bedeaux, S Kjelstrup
Chemical Physics Letters 504 (4), 199-201, 2011
992011
Thermodynamics of small systems embedded in a reservoir: a detailed analysis of finite size effects
SK Schnell, TJH Vlugt, JM Simon, D Bedeaux, S Kjelstrup
Molecular Physics 110 (11-12), 1069-1079, 2012
902012
Finite-size effects of Kirkwood–Buff integrals from molecular simulations
N Dawass, P Krüger, SK Schnell, D Bedeaux, S Kjelstrup, JM Simon, ...
Molecular Simulation 44 (7), 599-612, 2018
762018
Kirkwood-Buff integrals from molecular simulation
N Dawass, P Krüger, SK Schnell, JM Simon, TJH Vlugt
Fluid Phase Equilibria 486, 21-36, 2019
742019
Cryogenic vs. absorption biogas upgrading in liquefied biomethane production–An energy efficiency analysis
SE Hashemi, S Sarker, KM Lien, SK Schnell, B Austbř
Fuel 245, 294-304, 2019
712019
High-throughput computational screening of nanoporous adsorbents for CO 2 capture from natural gas
E Braun, AF Zurhelle, W Thijssen, SK Schnell, LC Lin, J Kim, ...
Molecular Systems Design & Engineering 1 (2), 175-188, 2016
662016
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
662013
CO 2 induced phase transitions in diamine-appended metal–organic frameworks
B Vlaisavljevich, SO Odoh, SK Schnell, AL Dzubak, K Lee, N Planas, ...
Chemical Science 6 (9), 5177-5185, 2015
512015
Size and shape effects on the thermodynamic properties of nanoscale volumes of water
BA Strřm, JM Simon, SK Schnell, S Kjelstrup, J He, D Bedeaux
Physical Chemistry Chemical Physics 19 (13), 9016-9027, 2017
452017
Nanothermodynamics—General Theory
D Bedeaux, S Kjelstrup, SK Schnell
PoreLab: Trondheim, Norway, 2020
422020
Translational and Rotational Motion of C8 Aromatics Adsorbed in Isotropic Porous Media (MOF-5): NMR Studies and MD Simulations
VJ Witherspoon, LM Yu, S Jawahery, E Braun, SM Moosavi, SK Schnell, ...
The Journal of Physical Chemistry C 121 (28), 15456-15462, 2017
352017
Partial molar enthalpies and reaction enthalpies from equilibrium molecular dynamics simulation
SK Schnell, R Skorpa, D Bedeaux, S Kjelstrup, TJH Vlugt, JM Simon
The Journal of chemical physics 141 (14), 2014
352014
Cassie–Baxter and Wenzel States and the Effect of Interfaces on Transport Properties across Membranes
MT Rauter, SK Schnell, S Kjelstrup
The Journal of Physical Chemistry B 125 (46), 12730-12740, 2021
322021
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