369 related articles for article (PubMed ID: 15260698)
1. Binary phase behavior and aggregation of dilute methanol in supercritical carbon dioxide: a Monte Carlo simulation study.
Stubbs JM; Siepmann JI
J Chem Phys; 2004 Jul; 121(3):1525-34. PubMed ID: 15260698
[TBL] [Abstract][Full Text] [Related]
2. Microscopic structure and interaction analysis for supercritical carbon dioxide-ethanol mixtures: a Monte Carlo simulation study.
Xu W; Yang J; Hu Y
J Phys Chem B; 2009 Apr; 113(14):4781-9. PubMed ID: 19338366
[TBL] [Abstract][Full Text] [Related]
3. Partial molar volume and solvation structure of naphthalene in supercritical carbon dioxide: a Monte Carlo simulation study.
Stubbs JM; Drake-Wilhelm DD; Siepmann JI
J Phys Chem B; 2005 Oct; 109(42):19885-92. PubMed ID: 16853571
[TBL] [Abstract][Full Text] [Related]
4. Pressure dependence of the vapor-liquid-liquid phase behavior in ternary mixtures consisting of n-alkanes, n-perfluoroalkanes, and carbon dioxide.
Zhang L; Siepmann JI
J Phys Chem B; 2005 Feb; 109(7):2911-9. PubMed ID: 16851304
[TBL] [Abstract][Full Text] [Related]
5. Computer simulations on aggregation of acetic acid in the gas phase, liquid phase, and supercritical carbon dioxide.
Xu W; Yang J
J Phys Chem A; 2010 Apr; 114(16):5377-88. PubMed ID: 20361792
[TBL] [Abstract][Full Text] [Related]
6. Gibbs ensemble Monte Carlo simulations of binary mixtures of methane, difluoromethane, and carbon dioxide.
Do H; Wheatley RJ; Hirst JD
J Phys Chem B; 2010 Mar; 114(11):3879-86. PubMed ID: 20184300
[TBL] [Abstract][Full Text] [Related]
7. Temperature dependence of hydrogen bonding: an investigation of the retention of primary and secondary alcohols in gas-liquid chromatography.
Sun L; Wick CD; Siepmann JI; Schure MR
J Phys Chem B; 2005 Aug; 109(31):15118-25. PubMed ID: 16852913
[TBL] [Abstract][Full Text] [Related]
8. Phase equilibria in carbon dioxide expanded solvents: Experiments and molecular simulations.
Houndonougbo Y; Jin H; Rajagopalan B; Wong K; Kuczera K; Subramaniam B; Laird B
J Phys Chem B; 2006 Jul; 110(26):13195-202. PubMed ID: 16805632
[TBL] [Abstract][Full Text] [Related]
9. Chain conformation and solvent partitioning in reversed-phase liquid chromatography: Monte Carlo simulations for various water/methanol concentrations.
Zhang L; Rafferty JL; Siepmann JI; Chen B; Schure MR
J Chromatogr A; 2006 Sep; 1126(1-2):219-31. PubMed ID: 16820151
[TBL] [Abstract][Full Text] [Related]
10. Molecular modeling of phase behavior and microstructure of acetone-chloroform-methanol binary mixtures.
Kamath G; Georgiev G; Potoff JJ
J Phys Chem B; 2005 Oct; 109(41):19463-73. PubMed ID: 16853515
[TBL] [Abstract][Full Text] [Related]
11. Monte Carlo predictions of phase equilibria and structure for dimethyl ether + sulfur dioxide and dimethyl ether + carbon dioxide.
Kamath G; Ketko M; Baker GA; Potoff JJ
J Chem Phys; 2012 Jan; 136(4):044514. PubMed ID: 22299898
[TBL] [Abstract][Full Text] [Related]
12. Solubility of carbon dioxide in aqueous solutions of methanol. Predictions by molecular simulation and comparison with experimental data.
Urukova I; Vorholz J; Maurer G
J Phys Chem B; 2006 Aug; 110(30):14943-9. PubMed ID: 16869608
[TBL] [Abstract][Full Text] [Related]
13. Thermodynamic behavior of the CO2 + NO2/N2O4 mixture: a Monte Carlo simulation study.
Bourasseau E; Lachet V; Desbiens N; Maillet JB; Teuler JM; Ungerer P
J Phys Chem B; 2008 Dec; 112(49):15783-92. PubMed ID: 19367990
[TBL] [Abstract][Full Text] [Related]
14. Reactive Monte Carlo and grand-canonical Monte Carlo simulations of the propene metathesis reaction system.
Hansen N; Jakobtorweihen S; Keil FJ
J Chem Phys; 2005 Apr; 122(16):164705. PubMed ID: 15945697
[TBL] [Abstract][Full Text] [Related]
15. Retention in gas-liquid chromatography with a polyethylene oxide stationary phase: molecular simulation and experiment.
Sun L; Siepmann JI; Klotz WL; Schure MR
J Chromatogr A; 2006 Sep; 1126(1-2):373-80. PubMed ID: 16814798
[TBL] [Abstract][Full Text] [Related]
16. TraPPE-UA force field for acrylates and Monte Carlo simulations for their mixtures with alkanes and alcohols.
Maerzke KA; Schultz NE; Ross RB; Siepmann JI
J Phys Chem B; 2009 May; 113(18):6415-25. PubMed ID: 19358558
[TBL] [Abstract][Full Text] [Related]
17. Monte carlo simulation of carboxylic acid phase equilibria.
Clifford S; Bolton K; Ramjugernath D
J Phys Chem B; 2006 Nov; 110(43):21938-43. PubMed ID: 17064162
[TBL] [Abstract][Full Text] [Related]
18. A computer simulation study on self- and cross-aggregation of multiple polar species in supercritical carbon dioxide.
Xu W; Yang J
J Phys Chem A; 2010 Apr; 114(16):5414-28. PubMed ID: 20359207
[TBL] [Abstract][Full Text] [Related]
19. Vapor-liquid and vapor-solid phase equilibria for united-atom benzene models near their triple points: the importance of quadrupolar interactions.
Zhao XS; Chen B; Karaborni S; Siepmann JI
J Phys Chem B; 2005 Mar; 109(11):5368-74. PubMed ID: 16863203
[TBL] [Abstract][Full Text] [Related]
20. Probing the nucleation mechanism for the binary n-nonane/1-alcohol series with atomistic simulations.
Nellas RB; McKenzie ME; Chen B
J Phys Chem B; 2006 Sep; 110(37):18619-28. PubMed ID: 16970491
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]