Sondre Kvalvåg Schnell
About
Nåværende PhD-studenter:
I'm also co-advising:
Our research is focused on numerical simulations, specifically focusing on thermodynamics properties, both in equilibrium and non-equilibrium. More specifically, we focus on two topics: transport in Magnesium Ion batteries, an alternative battery technology, and nanothermodynamics, which is describing thermal properties of systems consisting of just a few atoms. In our work we use molecular simulations, where we explicitly model single atoms, and how they interact with each other.
From the autumn 2018 we will start working on the RCN funded FRIPRO project NanoTherm, where we will study how thermodynamics can be used to describe connections between heat and energy in molecular machines.
Current Ph.D.-students:
Publications
2022
-
Bråten, Vilde;
Zhang, Daniel Tianhou;
Hammer, Morten;
Aasen, Ailo;
Schnell, Sondre Kvalvåg;
Wilhelmsen, Øivind.
(2022)
Equation of state for confined fluids.
Journal of Chemical Physics.
volum 156 (24).
Academic article
-
Hadler-Jacobsen, Jacob;
Schnell, Sondre Kvalvåg.
(2022)
The Importance of Stacking and Coordination for Li, Na, and Mg Diffusion and Intercalation in Ti<inf>3</inf>C<inf>2</inf>T<inf>2</inf> MXene.
Advanced Materials Interfaces.
volum 9 (17).
Academic article
-
Røe, Ingeborg Treu;
Schnell, Sondre Kvalvåg.
(2022)
Local surface crystal structure fluctuation on Li, Na and Mg metal anodes.
Molecular Physics.
volum 120 (9).
Academic article
2021
-
Bråten, Vilde;
Bedeaux, Dick;
Wilhelmsen, Øivind;
Schnell, Sondre Kvalvåg.
(2021)
Small Size Effects in Open and Closed Systems: What Can We Learn from Ideal Gases about Systems with Interacting Particles?.
Journal of Chemical Physics.
volum 155 (24).
Academic article
-
Bråten, Vilde;
Wilhelmsen, Øivind;
Schnell, Sondre Kvalvåg.
(2021)
Chemical Potential Differences in the Macroscopic Limit from Fluctuations in Small Systems.
Journal of Chemical Information and Modeling.
volum 61 (2).
Academic article
-
Hadler-Jacobsen, Jacob;
Fagerli, Frode Håskjold;
Kaland, Henning;
Schnell, Sondre Kvalvåg.
(2021)
Stacking Sequence, Interlayer Bonding, Termination Group Stability and Li/Na/Mg Diffusion in MXenes.
ACS Materials Letters.
volum 3 (9).
Academic article
-
Hashemi, Sayed Ebrahim;
Lien, Kristian Myklebust;
Hillestad, Magne;
Schnell, Sondre Kvalvåg;
Austbø, Bjørn.
(2021)
Thermodynamic Insight in Design of Methanation Reactor with Water Removal Considering Nexus between CO2 Conversion and Irreversibilities.
Energies.
volum 14 (23).
Academic article
-
Rauter, Michael Tobias;
Schnell, Sondre K.;
Kjelstrup, Signe.
(2021)
Cassie-Baxter and Wenzel States and the Effect of Interfaces on Transport Properties across Membranes.
Journal of Physical Chemistry B.
Academic article
-
Rauter, Michael Tobias;
Schnell, Sondre Kvalvåg;
Hafskjold, Bjørn;
Kjelstrup, Signe Helene.
(2021)
Thermo-osmotic pressure and resistance to mass transport in a vapor-gap membrane.
Physical Chemistry, Chemical Physics - PCCP.
volum 23.
Academic article
-
Røe, Ingeborg Treu;
Schnell, Sondre Kvalvåg.
(2021)
Slow surface diffusion on Cu substrates in Li metal batteries.
Journal of Materials Chemistry A.
volum 9 (17).
Academic article
-
Strøm, Bjørn André;
Bedeaux, Dick;
Schnell, Sondre Kvalvåg.
(2021)
Adsorption of an Ideal Gas on a Small Spherical Adsorbent.
Nanomaterials.
volum 11 (2).
Academic article
2020
-
Dawass, Noura;
Krüger, Peter;
Schnell, Sondre Kvalvåg;
Moultos, Othonas A.;
Economou, Ioannis;
Vlugt, Thijs J.H.;
Simon, Jean-Marc.
(2020)
Kirkwood–Buff Integrals Using Molecular Simulation: Estimation of Surface Effects.
Nanomaterials.
Academic article
-
Hashemi, Sayed Ebrahim;
Lien, Kristian Myklebust;
Schnell, Sondre Kvalvåg;
Austbø, Bjørn.
(2020)
Thermodynamic analysis of different methanation reactors for biogas upgrading.
Computer-aided chemical engineering.
volum 48.
Academic article
-
Kaland, Henning;
Hadler-Jacobsen, Jacob;
Fagerli, Frode Håskjold;
Wagner, Nils Peter;
Schnell, Sondre Kvalvåg;
Wiik, Kjell.
(2020)
Dipentamethylene thiuram tetrasulfide-based cathodes for rechargeable magnesium batteries.
ACS Applied Energy Materials.
volum 3.
Academic article
-
Kaland, Henning;
Hadler-Jacobsen, Jacob;
Fagerli, Frode Håskjold;
Wagner, Nils Peter;
Wang, Zhaohui;
Selbach, Sverre Magnus;
Vullum-Bruer, Fride;
Wiik, Kjell;
Schnell, Sondre Kvalvåg.
(2020)
Are MXenes Suitable as Cathode Materials for Rechargeable Mg Batteries?.
Sustainable Energy & Fuels.
volum 4 (6).
Academic article
-
Rauter, Michael Tobias;
Galteland, Olav;
Erdos, Mate;
Moultos, Othonas A.;
Vlugt, Thijs J.H.;
Schnell, Sondre Kvalvåg;
Bedeaux, Dick;
Kjelstrup, Signe.
(2020)
Two-Phase Equilibrium Conditions in Nanopores.
Nanomaterials.
volum 10 (4).
Academic article
-
Røe, Ingeborg Treu;
Selbach, Sverre Magnus;
Schnell, Sondre Kvalvåg.
(2020)
Crystal Structure Influences Migration along Li and Mg Surfaces.
The Journal of Physical Chemistry Letters.
volum 11 (8).
Academic article
2019
-
Dawass, Noura;
Krüger, Peter;
Schnell, Sondre Kvalvåg;
Simon, Jean-Marc;
Vlugt, Thijs J.H..
(2019)
Kirkwood-Buff integrals from molecular simulation.
Fluid Phase Equilibria.
volum 486.
Academic article
-
Hashemi, Sayed Ebrahim;
Lien, Kristian Myklebust;
Schnell, Sondre Kvalvåg;
Austbø, Bjørn.
(2019)
Optimization of an absorption-based biogas upgrading and liquefaction process.
Chemical Engineering Transactions.
volum 76.
Academic article
-
Hashemi, Sayed Ebrahim;
Sarker, Shiplu;
Lien, Kristian Myklebust;
Schnell, Sondre Kvalvåg;
Austbø, Bjørn.
(2019)
Cryogenic vs. absorption biogas upgrading in liquefied biomethane production – An energy efficiency analysis.
Fuel.
volum 245.
Academic article
-
Vlaisavljevich, Bess;
Schnell, Sondre Kvalvåg;
Dzubak, Allison L.;
Lee, Kyuho;
Planas, Nora;
Neaton, Jeffrey B.;
Gagliardi, Laura;
Smit, Berend.
(2019)
Correction: CO<inf>2</inf> induced phase transitions in diamine-appended metal-organic frameworks (Chemical Science (2015) 6 (5177-5185) DOI: 10.1039/c5sc01828e).
Chemical Science.
volum 10 (35).
Errata
2018
-
Dawass, Noura;
Kruger, Pieter;
Schnell, Sondre Kvalvåg;
Bedeaux, Dick;
Kjelstrup, Signe;
Simon, Jean Marc;
Vlugt, Thijs.
(2018)
Finite-size effects of Kirkwood–Buff integrals from molecular simulations.
Molecular Simulation.
volum 44 (7).
Academic article
2017
-
Strøm, Bjørn;
Simon, Jean-Marc;
Schnell, Sondre Kvalvåg;
Kjelstrup, Signe;
He, Jianying;
Bedeaux, Dick.
(2017)
Size and shape effects on the thermodynamic properties of nanoscale volumes of water.
Physical Chemistry, Chemical Physics - PCCP.
volum 19 (13).
Academic article
-
Witherspoon, Velencia J.;
Yu, Lucy M.;
Jawahery, Sudi;
Braun, Efrem;
Moosavi, Seyed Mohamad;
Schnell, Sondre Kvalvåg;
Smit, Berend;
Reimer, Jeffrey A..
(2017)
Translational and Rotational Motion of C8 Aromatics Adsorbed in Isotropic Porous Media (MOF-5): NMR Studies and MD Simulations.
Journal of Physical Chemistry C.
volum 121 (28).
Academic article
2016
-
Braun, Efrem;
Zurhelle, Alexander;
Thijssen, Wouter;
Schnell, Sondre Kvalvåg;
Lin, Li-Chiang;
Kim, Jihan;
Thompson, Joshua;
Smit, Berend.
(2016)
High-throughput computational screening of nanoporous adsorbents for CO<inf>2</inf> capture from natural gas.
Molecular Systems Design & Engineering.
volum 1 (2).
Academic article
-
Kjelstrup, Signe Helene;
Skorpa, Ragnhild;
Schnell, Sondre Kvalvåg;
Bedeaux, Dick.
(2016)
Computing properties of the hydrogen dissociation reaction in and away from equilibrium.
Molecular Simulation.
volum 42 (16).
Academic article
2015
-
Braun, Efrem;
Chen, Joseph J.;
Schnell, Sondre Kvalvåg;
Lin, Li-Chiang;
Reimer, Jeffrey A.;
Smit, Berend.
(2015)
Nanoporous materials can tune the critical point of a pure substance.
Angewandte Chemie International Edition.
volum 54 (48).
Academic article
-
Brunchi, Cristian C.;
Englebienne, Pablo;
Kramer, Herman J. M.;
Schnell, Sondre Kvalvåg;
Vlugt, Thijs J.H..
(2015)
Evaluating adsorbed-phase activity coefficient models using a 2D-lattice model.
Molecular Simulation.
volum 41 (15).
Academic article
-
McDonald, Thomas M.;
Mason, Jarad A.;
Kong, Xueqian;
Bloch, Eric D.;
Gygi, David;
Dani, Alessandro;
Crocella, Valentina;
Giordanino, Filippo;
Odoh, Samuel O.;
Drisdell, Walter S.;
Vlaisavljevich, Bess;
Dzubak, Allison L.;
Poloni, Roberta;
Schnell, Sondre Kvalvåg;
Planas, Nora;
Lee, Kyuho;
Pascal, Tod;
Wan, Liwen F.;
Prendergast, David.
(2015)
Cooperative insertion of CO2 in diamine-appended metal-organic frameworks.
Nature.
volum 519 (7543).
Academic article
-
Simon, Cory M.;
Mercado, Rocio;
Schnell, Sondre Kvalvåg;
Smit, Berend;
Haranczyk, Maciej.
(2015)
What Are the Best Materials To Separate a Xenon/Krypton Mixture?.
Chemistry of Materials.
volum 27 (12).
Academic article
-
Vlaisavljevich, Bess;
Odoh, Samuel O.;
Schnell, Sondre Kvalvåg;
Dzubak, Allison L.;
Lee, Kyuho;
Planas, Nora;
Neaton, Jeffrey B.;
Gagliardi, Laura;
Smit, Berend.
(2015)
CO2 induced phase transitions in diamine-appended metal-organic frameworks.
Chemical Science.
volum 6 (9).
Academic article
2014
-
Schnell, Sondre Kvalvåg;
Skorpa, Ragnhild;
Bedeaux, Dick;
Kjelstrup, Signe;
Vlugt, Thijs J.H.;
Simon, Jean-Marc.
(2014)
Partial molar enthalpies and reaction enthalpies from equilibrium molecular dynamics simulation.
Journal of Chemical Physics.
volum 141 (14).
Academic article
2013
-
Krüger, Peter;
Schnell, Sondre Kvalvåg;
Bedeaux, Dick;
Kjelstrup, Signe;
Vlugt, Thijs;
Simon, Jean-Marc.
(2013)
Kirkwood-Buff Integrals for Finite Volumes.
The Journal of Physical Chemistry Letters.
volum 4 (2).
Academic article
2012
-
Liu, Xin;
Martin-Calvo, Ana;
McGarrity, Erin;
Schnell, Sondre Kvalvåg;
Calero, S;
Simon, Jean-Marc;
Bedeaux, Dick;
Kjelstrup, Signe;
Bardow, Andrew;
Vlugt, Thijs.
(2012)
Fick Diffusion Coefficients in Ternary Liquid Systems from Equilibrium Molecular Dynamics Simulations.
Industrial & Engineering Chemistry Research.
volum 51 (30).
Academic article
-
Skorpa, Ragnhild;
Voldsund, Mari;
Takla, Marit;
Schnell, Sondre Kvalvåg;
Bedeaux, Dick;
Kjelstrup, Signe.
(2012)
Assessing the coupled heat and mass transport of hydrogen through a palladium membrane.
Journal of Membrane Science.
volum 394-395.
Academic article
2011
-
Garcia-Perez, E;
Schnell, Sondre Kvalvåg;
Castillo, JM;
Calero, S;
Kjelstrup, Signe;
Dubbeldam, D;
Vlugt, Thijs.
(2011)
External Surface Adsorption on Silicalite-1 Zeolite Studied by Molecular Simulation.
Journal of Physical Chemistry C.
volum 115 (31).
Academic article
-
Schnell, Sondre Kvalvåg;
Liu, Xin;
Simon, Jean-Marc;
Bardow, Andrew;
Bedeaux, Dick;
Vlugt, Thijs;
Kjelstrup, Signe.
(2011)
Calculating Thermodynamic Properties from Fluctuations at Small Scales.
Journal of Physical Chemistry B.
volum 115 (37).
Academic article
Journal publications
-
Bråten, Vilde;
Zhang, Daniel Tianhou;
Hammer, Morten;
Aasen, Ailo;
Schnell, Sondre Kvalvåg;
Wilhelmsen, Øivind.
(2022)
Equation of state for confined fluids.
Journal of Chemical Physics.
volum 156 (24).
Academic article
-
Hadler-Jacobsen, Jacob;
Schnell, Sondre Kvalvåg.
(2022)
The Importance of Stacking and Coordination for Li, Na, and Mg Diffusion and Intercalation in Ti<inf>3</inf>C<inf>2</inf>T<inf>2</inf> MXene.
Advanced Materials Interfaces.
volum 9 (17).
Academic article
-
Røe, Ingeborg Treu;
Schnell, Sondre Kvalvåg.
(2022)
Local surface crystal structure fluctuation on Li, Na and Mg metal anodes.
Molecular Physics.
volum 120 (9).
Academic article
-
Bråten, Vilde;
Bedeaux, Dick;
Wilhelmsen, Øivind;
Schnell, Sondre Kvalvåg.
(2021)
Small Size Effects in Open and Closed Systems: What Can We Learn from Ideal Gases about Systems with Interacting Particles?.
Journal of Chemical Physics.
volum 155 (24).
Academic article
-
Bråten, Vilde;
Wilhelmsen, Øivind;
Schnell, Sondre Kvalvåg.
(2021)
Chemical Potential Differences in the Macroscopic Limit from Fluctuations in Small Systems.
Journal of Chemical Information and Modeling.
volum 61 (2).
Academic article
-
Hadler-Jacobsen, Jacob;
Fagerli, Frode Håskjold;
Kaland, Henning;
Schnell, Sondre Kvalvåg.
(2021)
Stacking Sequence, Interlayer Bonding, Termination Group Stability and Li/Na/Mg Diffusion in MXenes.
ACS Materials Letters.
volum 3 (9).
Academic article
-
Hashemi, Sayed Ebrahim;
Lien, Kristian Myklebust;
Hillestad, Magne;
Schnell, Sondre Kvalvåg;
Austbø, Bjørn.
(2021)
Thermodynamic Insight in Design of Methanation Reactor with Water Removal Considering Nexus between CO2 Conversion and Irreversibilities.
Energies.
volum 14 (23).
Academic article
-
Rauter, Michael Tobias;
Schnell, Sondre K.;
Kjelstrup, Signe.
(2021)
Cassie-Baxter and Wenzel States and the Effect of Interfaces on Transport Properties across Membranes.
Journal of Physical Chemistry B.
Academic article
-
Rauter, Michael Tobias;
Schnell, Sondre Kvalvåg;
Hafskjold, Bjørn;
Kjelstrup, Signe Helene.
(2021)
Thermo-osmotic pressure and resistance to mass transport in a vapor-gap membrane.
Physical Chemistry, Chemical Physics - PCCP.
volum 23.
Academic article
-
Røe, Ingeborg Treu;
Schnell, Sondre Kvalvåg.
(2021)
Slow surface diffusion on Cu substrates in Li metal batteries.
Journal of Materials Chemistry A.
volum 9 (17).
Academic article
-
Strøm, Bjørn André;
Bedeaux, Dick;
Schnell, Sondre Kvalvåg.
(2021)
Adsorption of an Ideal Gas on a Small Spherical Adsorbent.
Nanomaterials.
volum 11 (2).
Academic article
-
Dawass, Noura;
Krüger, Peter;
Schnell, Sondre Kvalvåg;
Moultos, Othonas A.;
Economou, Ioannis;
Vlugt, Thijs J.H.;
Simon, Jean-Marc.
(2020)
Kirkwood–Buff Integrals Using Molecular Simulation: Estimation of Surface Effects.
Nanomaterials.
Academic article
-
Hashemi, Sayed Ebrahim;
Lien, Kristian Myklebust;
Schnell, Sondre Kvalvåg;
Austbø, Bjørn.
(2020)
Thermodynamic analysis of different methanation reactors for biogas upgrading.
Computer-aided chemical engineering.
volum 48.
Academic article
-
Kaland, Henning;
Hadler-Jacobsen, Jacob;
Fagerli, Frode Håskjold;
Wagner, Nils Peter;
Schnell, Sondre Kvalvåg;
Wiik, Kjell.
(2020)
Dipentamethylene thiuram tetrasulfide-based cathodes for rechargeable magnesium batteries.
ACS Applied Energy Materials.
volum 3.
Academic article
-
Kaland, Henning;
Hadler-Jacobsen, Jacob;
Fagerli, Frode Håskjold;
Wagner, Nils Peter;
Wang, Zhaohui;
Selbach, Sverre Magnus;
Vullum-Bruer, Fride;
Wiik, Kjell;
Schnell, Sondre Kvalvåg.
(2020)
Are MXenes Suitable as Cathode Materials for Rechargeable Mg Batteries?.
Sustainable Energy & Fuels.
volum 4 (6).
Academic article
-
Rauter, Michael Tobias;
Galteland, Olav;
Erdos, Mate;
Moultos, Othonas A.;
Vlugt, Thijs J.H.;
Schnell, Sondre Kvalvåg;
Bedeaux, Dick;
Kjelstrup, Signe.
(2020)
Two-Phase Equilibrium Conditions in Nanopores.
Nanomaterials.
volum 10 (4).
Academic article
-
Røe, Ingeborg Treu;
Selbach, Sverre Magnus;
Schnell, Sondre Kvalvåg.
(2020)
Crystal Structure Influences Migration along Li and Mg Surfaces.
The Journal of Physical Chemistry Letters.
volum 11 (8).
Academic article
-
Dawass, Noura;
Krüger, Peter;
Schnell, Sondre Kvalvåg;
Simon, Jean-Marc;
Vlugt, Thijs J.H..
(2019)
Kirkwood-Buff integrals from molecular simulation.
Fluid Phase Equilibria.
volum 486.
Academic article
-
Hashemi, Sayed Ebrahim;
Lien, Kristian Myklebust;
Schnell, Sondre Kvalvåg;
Austbø, Bjørn.
(2019)
Optimization of an absorption-based biogas upgrading and liquefaction process.
Chemical Engineering Transactions.
volum 76.
Academic article
-
Hashemi, Sayed Ebrahim;
Sarker, Shiplu;
Lien, Kristian Myklebust;
Schnell, Sondre Kvalvåg;
Austbø, Bjørn.
(2019)
Cryogenic vs. absorption biogas upgrading in liquefied biomethane production – An energy efficiency analysis.
Fuel.
volum 245.
Academic article
-
Vlaisavljevich, Bess;
Schnell, Sondre Kvalvåg;
Dzubak, Allison L.;
Lee, Kyuho;
Planas, Nora;
Neaton, Jeffrey B.;
Gagliardi, Laura;
Smit, Berend.
(2019)
Correction: CO<inf>2</inf> induced phase transitions in diamine-appended metal-organic frameworks (Chemical Science (2015) 6 (5177-5185) DOI: 10.1039/c5sc01828e).
Chemical Science.
volum 10 (35).
Errata
-
Dawass, Noura;
Kruger, Pieter;
Schnell, Sondre Kvalvåg;
Bedeaux, Dick;
Kjelstrup, Signe;
Simon, Jean Marc;
Vlugt, Thijs.
(2018)
Finite-size effects of Kirkwood–Buff integrals from molecular simulations.
Molecular Simulation.
volum 44 (7).
Academic article
-
Strøm, Bjørn;
Simon, Jean-Marc;
Schnell, Sondre Kvalvåg;
Kjelstrup, Signe;
He, Jianying;
Bedeaux, Dick.
(2017)
Size and shape effects on the thermodynamic properties of nanoscale volumes of water.
Physical Chemistry, Chemical Physics - PCCP.
volum 19 (13).
Academic article
-
Witherspoon, Velencia J.;
Yu, Lucy M.;
Jawahery, Sudi;
Braun, Efrem;
Moosavi, Seyed Mohamad;
Schnell, Sondre Kvalvåg;
Smit, Berend;
Reimer, Jeffrey A..
(2017)
Translational and Rotational Motion of C8 Aromatics Adsorbed in Isotropic Porous Media (MOF-5): NMR Studies and MD Simulations.
Journal of Physical Chemistry C.
volum 121 (28).
Academic article
-
Braun, Efrem;
Zurhelle, Alexander;
Thijssen, Wouter;
Schnell, Sondre Kvalvåg;
Lin, Li-Chiang;
Kim, Jihan;
Thompson, Joshua;
Smit, Berend.
(2016)
High-throughput computational screening of nanoporous adsorbents for CO<inf>2</inf> capture from natural gas.
Molecular Systems Design & Engineering.
volum 1 (2).
Academic article
-
Kjelstrup, Signe Helene;
Skorpa, Ragnhild;
Schnell, Sondre Kvalvåg;
Bedeaux, Dick.
(2016)
Computing properties of the hydrogen dissociation reaction in and away from equilibrium.
Molecular Simulation.
volum 42 (16).
Academic article
-
Braun, Efrem;
Chen, Joseph J.;
Schnell, Sondre Kvalvåg;
Lin, Li-Chiang;
Reimer, Jeffrey A.;
Smit, Berend.
(2015)
Nanoporous materials can tune the critical point of a pure substance.
Angewandte Chemie International Edition.
volum 54 (48).
Academic article
-
Brunchi, Cristian C.;
Englebienne, Pablo;
Kramer, Herman J. M.;
Schnell, Sondre Kvalvåg;
Vlugt, Thijs J.H..
(2015)
Evaluating adsorbed-phase activity coefficient models using a 2D-lattice model.
Molecular Simulation.
volum 41 (15).
Academic article
-
McDonald, Thomas M.;
Mason, Jarad A.;
Kong, Xueqian;
Bloch, Eric D.;
Gygi, David;
Dani, Alessandro;
Crocella, Valentina;
Giordanino, Filippo;
Odoh, Samuel O.;
Drisdell, Walter S.;
Vlaisavljevich, Bess;
Dzubak, Allison L.;
Poloni, Roberta;
Schnell, Sondre Kvalvåg;
Planas, Nora;
Lee, Kyuho;
Pascal, Tod;
Wan, Liwen F.;
Prendergast, David.
(2015)
Cooperative insertion of CO2 in diamine-appended metal-organic frameworks.
Nature.
volum 519 (7543).
Academic article
-
Simon, Cory M.;
Mercado, Rocio;
Schnell, Sondre Kvalvåg;
Smit, Berend;
Haranczyk, Maciej.
(2015)
What Are the Best Materials To Separate a Xenon/Krypton Mixture?.
Chemistry of Materials.
volum 27 (12).
Academic article
-
Vlaisavljevich, Bess;
Odoh, Samuel O.;
Schnell, Sondre Kvalvåg;
Dzubak, Allison L.;
Lee, Kyuho;
Planas, Nora;
Neaton, Jeffrey B.;
Gagliardi, Laura;
Smit, Berend.
(2015)
CO2 induced phase transitions in diamine-appended metal-organic frameworks.
Chemical Science.
volum 6 (9).
Academic article
-
Schnell, Sondre Kvalvåg;
Skorpa, Ragnhild;
Bedeaux, Dick;
Kjelstrup, Signe;
Vlugt, Thijs J.H.;
Simon, Jean-Marc.
(2014)
Partial molar enthalpies and reaction enthalpies from equilibrium molecular dynamics simulation.
Journal of Chemical Physics.
volum 141 (14).
Academic article
-
Krüger, Peter;
Schnell, Sondre Kvalvåg;
Bedeaux, Dick;
Kjelstrup, Signe;
Vlugt, Thijs;
Simon, Jean-Marc.
(2013)
Kirkwood-Buff Integrals for Finite Volumes.
The Journal of Physical Chemistry Letters.
volum 4 (2).
Academic article
-
Liu, Xin;
Martin-Calvo, Ana;
McGarrity, Erin;
Schnell, Sondre Kvalvåg;
Calero, S;
Simon, Jean-Marc;
Bedeaux, Dick;
Kjelstrup, Signe;
Bardow, Andrew;
Vlugt, Thijs.
(2012)
Fick Diffusion Coefficients in Ternary Liquid Systems from Equilibrium Molecular Dynamics Simulations.
Industrial & Engineering Chemistry Research.
volum 51 (30).
Academic article
-
Skorpa, Ragnhild;
Voldsund, Mari;
Takla, Marit;
Schnell, Sondre Kvalvåg;
Bedeaux, Dick;
Kjelstrup, Signe.
(2012)
Assessing the coupled heat and mass transport of hydrogen through a palladium membrane.
Journal of Membrane Science.
volum 394-395.
Academic article
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Garcia-Perez, E;
Schnell, Sondre Kvalvåg;
Castillo, JM;
Calero, S;
Kjelstrup, Signe;
Dubbeldam, D;
Vlugt, Thijs.
(2011)
External Surface Adsorption on Silicalite-1 Zeolite Studied by Molecular Simulation.
Journal of Physical Chemistry C.
volum 115 (31).
Academic article
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Schnell, Sondre Kvalvåg;
Liu, Xin;
Simon, Jean-Marc;
Bardow, Andrew;
Bedeaux, Dick;
Vlugt, Thijs;
Kjelstrup, Signe.
(2011)
Calculating Thermodynamic Properties from Fluctuations at Small Scales.
Journal of Physical Chemistry B.
volum 115 (37).
Academic article
Teaching
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2022
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PosterKroyan, Arpenik; Schnell, Sondre Kvalvåg. (2022) A comparison of atomistic force fields for dynamic RNA properties. 32nd European Symposium on Applied Thermodynamics 2022 . Graz University of Technology; Graz. 2022-07-17 - 2022-07-20.