Schnell SK - Search Results

1

Chemical Potential Differences in the Macroscopic Limit from Fluctuations in Small Systems.

Bråten V, Wilhelmsen Ø, Schnell SK. Bråten V, et al. Among authors: schnell sk. J Chem Inf Model. 2021 Feb 22;61(2):840-855. doi: 10.1021/acs.jcim.0c01367. Epub 2021 Feb 10. J Chem Inf Model. 2021. PMID: 33566592 Free PMC article.

2

Small size effects in open and closed systems: What can we learn from ideal gases about systems with interacting particles?

Bråten V, Bedeaux D, Wilhelmsen Ø, Schnell SK. Bråten V, et al. Among authors: schnell sk. J Chem Phys. 2021 Dec 28;155(24):244504. doi: 10.1063/5.0076684. J Chem Phys. 2021. PMID: 34972373

3

Equation of state for confined fluids.

Bråten V, Zhang DT, Hammer M, Aasen A, Schnell SK, Wilhelmsen Ø. Bråten V, et al. Among authors: schnell sk. J Chem Phys. 2022 Jun 28;156(24):244504. doi: 10.1063/5.0096875. J Chem Phys. 2022. PMID: 35778084

4

Kirkwood-Buff integrals: From fluctuations in finite volumes to the thermodynamic limit.

Simon JM, Krüger P, Schnell SK, Vlugt TJH, Kjelstrup S, Bedeaux D. Simon JM, et al. Among authors: schnell sk. J Chem Phys. 2022 Oct 7;157(13):130901. doi: 10.1063/5.0106162. J Chem Phys. 2022. PMID: 36209013

5

Calculating thermodynamic properties from fluctuations at small scales.

Schnell SK, Liu X, Simon JM, Bardow A, Bedeaux D, Vlugt TJ, Kjelstrup S. Schnell SK, et al. J Phys Chem B. 2011 Sep 22;115(37):10911-8. doi: 10.1021/jp204347p. Epub 2011 Aug 26. J Phys Chem B. 2011. PMID: 21838274

6

Partial molar enthalpies and reaction enthalpies from equilibrium molecular dynamics simulation.

Schnell SK, Skorpa R, Bedeaux D, Kjelstrup S, Vlugt TJ, Simon JM. Schnell SK, et al. J Chem Phys. 2014 Oct 14;141(14):144501. doi: 10.1063/1.4896939. J Chem Phys. 2014. PMID: 25318729

7

Adsorption of an Ideal Gas on a Small Spherical Adsorbent.

Strøm BA, Bedeaux D, Schnell SK. Strøm BA, et al. Among authors: schnell sk. Nanomaterials (Basel). 2021 Feb 9;11(2):431. doi: 10.3390/nano11020431. Nanomaterials (Basel). 2021. PMID: 33572075 Free PMC article.

8

Cassie-Baxter and Wenzel States and the Effect of Interfaces on Transport Properties across Membranes.

Rauter MT, Schnell SK, Kjelstrup S. Rauter MT, et al. Among authors: schnell sk. J Phys Chem B. 2021 Nov 25;125(46):12730-12740. doi: 10.1021/acs.jpcb.1c07931. Epub 2021 Nov 10. J Phys Chem B. 2021. PMID: 34755514 Free PMC article.

9

Size and shape effects on the thermodynamic properties of nanoscale volumes of water.

Strøm BA, Simon JM, Schnell SK, Kjelstrup S, He J, Bedeaux D. Strøm BA, et al. Among authors: schnell sk. Phys Chem Chem Phys. 2017 Mar 29;19(13):9016-9027. doi: 10.1039/c7cp00874k. Phys Chem Chem Phys. 2017. PMID: 28304038

10

CO₂ induced phase transitions in diamine-appended metal-organic frameworks.

Vlaisavljevich B, Odoh SO, Schnell SK, Dzubak AL, Lee K, Planas N, Neaton JB, Gagliardi L, Smit B. Vlaisavljevich B, et al. Among authors: schnell sk. Chem Sci. 2015 Sep 1;6(9):5177-5185. doi: 10.1039/c5sc01828e. Epub 2015 Jun 17. Chem Sci. 2015. PMID: 28717499 Free PMC article.

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