161 related articles for article (PubMed ID: 26274482)
1. Resolving Discrepancies in the Measurements of the Interfacial Tension for the CO2 + H2O Mixture by Computer Simulation.
Müller EA; Mejía A
J Phys Chem Lett; 2014 Apr; 5(7):1267-71. PubMed ID: 26274482
[TBL] [Abstract][Full Text] [Related]
2. SAFT-γ force field for the simulation of molecular fluids. 1. A single-site coarse grained model of carbon dioxide.
Avendaño C; Lafitte T; Galindo A; Adjiman CS; Jackson G; Müller EA
J Phys Chem B; 2011 Sep; 115(38):11154-69. PubMed ID: 21815624
[TBL] [Abstract][Full Text] [Related]
3. Artificial multiple criticality and phase equilibria: an investigation of the PC-SAFT approach.
Yelash L; Müller M; Paul W; Binder K
Phys Chem Chem Phys; 2005 Nov; 7(21):3728-32. PubMed ID: 16358021
[TBL] [Abstract][Full Text] [Related]
4. Force-field parameters from the SAFT-γ equation of state for use in coarse-grained molecular simulations.
Müller EA; Jackson G
Annu Rev Chem Biomol Eng; 2014; 5():405-27. PubMed ID: 24702297
[TBL] [Abstract][Full Text] [Related]
5. SAFT-γ force field for the simulation of molecular fluids: 2. Coarse-grained models of greenhouse gases, refrigerants, and long alkanes.
Avendaño C; Lafitte T; Adjiman CS; Galindo A; Müller EA; Jackson G
J Phys Chem B; 2013 Mar; 117(9):2717-33. PubMed ID: 23311931
[TBL] [Abstract][Full Text] [Related]
6. Interfacial properties of water/CO2: a comprehensive description through a Gradient Theory-SAFT-VR Mie approach.
Lafitte T; Mendiboure B; Piñeiro MM; Bessières D; Miqueu C
J Phys Chem B; 2010 Sep; 114(34):11110-6. PubMed ID: 20698517
[TBL] [Abstract][Full Text] [Related]
7. Coarse-Graining the Liquid-Liquid Interfaces with the MARTINI Force Field: How Is the Interfacial Tension Reproduced?
Ndao M; Devémy J; Ghoufi A; Malfreyt P
J Chem Theory Comput; 2015 Aug; 11(8):3818-28. PubMed ID: 26574463
[TBL] [Abstract][Full Text] [Related]
8. Density functional theory for the prediction of interfacial properties of molecular fluids within the SAFT-γ coarse-grained approach.
Algaba J; Mendiboure B; Gómez-Álvarez P; Blas FJ
RSC Adv; 2022 Jun; 12(29):18821-18833. PubMed ID: 35873311
[TBL] [Abstract][Full Text] [Related]
9. Molecular insights into fluid-solid interfacial tensions in water + gas + solid systems at various temperatures and pressures.
Yang Y; Wan J; Shang X; Sun S
J Chem Phys; 2023 Sep; 159(9):. PubMed ID: 37655769
[TBL] [Abstract][Full Text] [Related]
10. A global investigation of phase equilibria using the perturbed-chain statistical-associating-fluid-theory approach.
Yelash L; Müller M; Paul W; Binder K
J Chem Phys; 2005 Jul; 123(1):014908. PubMed ID: 16035870
[TBL] [Abstract][Full Text] [Related]
11. Quantitative Predictions of the Interfacial Tensions of Liquid-Liquid Interfaces through Atomistic and Coarse Grained Models.
Neyt JC; Wender A; Lachet V; Ghoufi A; Malfreyt P
J Chem Theory Comput; 2014 May; 10(5):1887-99. PubMed ID: 26580519
[TBL] [Abstract][Full Text] [Related]
12. On interfacial properties of tetrahydrofuran: Atomistic and coarse-grained models from molecular dynamics simulation.
Garrido JM; Algaba J; Míguez JM; Mendiboure B; Moreno-Ventas Bravo AI; Piñeiro MM; Blas FJ
J Chem Phys; 2016 Apr; 144(14):144702. PubMed ID: 27083740
[TBL] [Abstract][Full Text] [Related]
13. Interfacial tension and wettability in water-carbon dioxide systems: experiments and self-consistent field modeling.
Banerjee S; Hassenklöver E; Kleijn JM; Cohen Stuart MA; Leermakers FA
J Phys Chem B; 2013 Jul; 117(28):8524-35. PubMed ID: 23834700
[TBL] [Abstract][Full Text] [Related]
14. Probing the Interfacial Behavior of Type IIIa Binary Mixtures Along the Three-Phase Line Employing Molecular Thermodynamics.
Alonso G; Chaparro G; Cartes M; Müller EA; Mejía A
Molecules; 2020 Mar; 25(7):. PubMed ID: 32218362
[TBL] [Abstract][Full Text] [Related]
15. Predicting mixture phase equilibria and critical behavior using the SAFT-VRX approach.
Sun L; Zhao H; Kiselev SB; McCabe C
J Phys Chem B; 2005 May; 109(18):9047-58. PubMed ID: 16852077
[TBL] [Abstract][Full Text] [Related]
16. Development of a fused-sphere SAFT-γ Mie force field for poly(vinyl alcohol) and poly(ethylene).
Walker CC; Genzer J; Santiso EE
J Chem Phys; 2019 Jan; 150(3):034901. PubMed ID: 30660157
[TBL] [Abstract][Full Text] [Related]
17. Extension of the SAFT-VR Mie EoS To Model Homonuclear Rings and Its Parametrization Based on the Principle of Corresponding States.
Müller EA; Mejía A
Langmuir; 2017 Oct; 33(42):11518-11529. PubMed ID: 28602088
[TBL] [Abstract][Full Text] [Related]
18. An examination of the ternary methane + carbon dioxide + water phase diagram using the SAFT-VR approach.
Míguez JM; dos Ramos MC; Piñeiro MM; Blas FJ
J Phys Chem B; 2011 Aug; 115(31):9604-17. PubMed ID: 21711035
[TBL] [Abstract][Full Text] [Related]
19. Adapting SAFT-γ perturbation theory to site-based molecular dynamics simulation. I. Homogeneous fluids.
Ghobadi AF; Elliott JR
J Chem Phys; 2013 Dec; 139(23):234104. PubMed ID: 24359349
[TBL] [Abstract][Full Text] [Related]
20. An accurate density functional theory for the vapor-liquid interface of chain molecules based on the statistical associating fluid theory for potentials of variable range for Mie chainlike fluids.
Algaba J; Míguez JM; Mendiboure B; Blas FJ
Phys Chem Chem Phys; 2019 Jun; 21(22):11937-11948. PubMed ID: 31134241
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]