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925 related items for PubMed ID: 16863358

  • 1. Vapor-liquid equilibria from the triple point up to the critical point for the new generation of TIP4P-like models: TIP4P/Ew, TIP4P/2005, and TIP4P/ice.
    Vega C, Abascal JL, Nezbeda I.
    J Chem Phys; 2006 Jul 21; 125(3):34503. PubMed ID: 16863358
    [Abstract] [Full Text] [Related]

  • 2. Characterization of the TIP4P-Ew water model: vapor pressure and boiling point.
    Horn HW, Swope WC, Pitera JW.
    J Chem Phys; 2005 Nov 15; 123(19):194504. PubMed ID: 16321097
    [Abstract] [Full Text] [Related]

  • 3. The melting temperature of the most common models of water.
    Vega C, Sanz E, Abascal JL.
    J Chem Phys; 2005 Mar 15; 122(11):114507. PubMed ID: 15836229
    [Abstract] [Full Text] [Related]

  • 4. Surface tension of the most popular models of water by using the test-area simulation method.
    Vega C, de Miguel E.
    J Chem Phys; 2007 Apr 21; 126(15):154707. PubMed ID: 17461659
    [Abstract] [Full Text] [Related]

  • 5. Melting temperature of ice Ih calculated from coexisting solid-liquid phases.
    Wang J, Yoo S, Bai J, Morris JR, Zeng XC.
    J Chem Phys; 2005 Jul 15; 123(3):36101. PubMed ID: 16080767
    [Abstract] [Full Text] [Related]

  • 6. The melting point of ice Ih for common water models calculated from direct coexistence of the solid-liquid interface.
    García Fernández R, Abascal JL, Vega C.
    J Chem Phys; 2006 Apr 14; 124(14):144506. PubMed ID: 16626213
    [Abstract] [Full Text] [Related]

  • 7. 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 24; 109(11):5368-74. PubMed ID: 16863203
    [Abstract] [Full Text] [Related]

  • 8. Limitations of the rigid planar nonpolarizable models of water.
    Baranyai A, Bartók A, Chialvo AA.
    J Chem Phys; 2006 Feb 21; 124(7):74507. PubMed ID: 16497057
    [Abstract] [Full Text] [Related]

  • 9. The phase diagram of water at high pressures as obtained by computer simulations of the TIP4P/2005 model: the appearance of a plastic crystal phase.
    Aragones JL, Conde MM, Noya EG, Vega C.
    Phys Chem Chem Phys; 2009 Jan 21; 11(3):543-55. PubMed ID: 19283272
    [Abstract] [Full Text] [Related]

  • 10. Determining the three-phase coexistence line in methane hydrates using computer simulations.
    Conde MM, Vega C.
    J Chem Phys; 2010 Aug 14; 133(6):064507. PubMed ID: 20707575
    [Abstract] [Full Text] [Related]

  • 11. The phase diagram of water at negative pressures: virtual ices.
    Conde MM, Vega C, Tribello GA, Slater B.
    J Chem Phys; 2009 Jul 21; 131(3):034510. PubMed ID: 19624212
    [Abstract] [Full Text] [Related]

  • 12. Relation between the melting temperature and the temperature of maximum density for the most common models of water.
    Vega C, Abascal JL.
    J Chem Phys; 2005 Oct 08; 123(14):144504. PubMed ID: 16238404
    [Abstract] [Full Text] [Related]

  • 13. Molecular dynamics simulations of vapor/liquid coexistence using the nonpolarizable water models.
    Sakamaki R, Sum AK, Narumi T, Yasuoka K.
    J Chem Phys; 2011 Mar 28; 134(12):124708. PubMed ID: 21456696
    [Abstract] [Full Text] [Related]

  • 14. Liquid-liquid phase transitions in supercooled water studied by computer simulations of various water models.
    Brovchenko I, Geiger A, Oleinikova A.
    J Chem Phys; 2005 Jul 22; 123(4):044515. PubMed ID: 16095377
    [Abstract] [Full Text] [Related]

  • 15. Melting point and phase diagram of methanol as obtained from computer simulations of the OPLS model.
    Gonzalez Salgado D, Vega C.
    J Chem Phys; 2010 Mar 07; 132(9):094505. PubMed ID: 20210403
    [Abstract] [Full Text] [Related]

  • 16. Computer simulation of two new solid phases of water: Ice XIII and ice XIV.
    Martin-Conde M, MacDowell LG, Vega C.
    J Chem Phys; 2006 Sep 21; 125(11):116101. PubMed ID: 16999507
    [Abstract] [Full Text] [Related]

  • 17. A potential model for the study of ices and amorphous water: TIP4P/Ice.
    Abascal JL, Sanz E, García Fernández R, Vega C.
    J Chem Phys; 2005 Jun 15; 122(23):234511. PubMed ID: 16008466
    [Abstract] [Full Text] [Related]

  • 18. The thickness of a liquid layer on the free surface of ice as obtained from computer simulation.
    Conde MM, Vega C, Patrykiejew A.
    J Chem Phys; 2008 Jul 07; 129(1):014702. PubMed ID: 18624491
    [Abstract] [Full Text] [Related]

  • 19. Capillary waves at the liquid-vapor interface and the surface tension of water.
    Ismail AE, Grest GS, Stevens MJ.
    J Chem Phys; 2006 Jul 07; 125(1):014702. PubMed ID: 16863319
    [Abstract] [Full Text] [Related]

  • 20. Properties of ices at 0 K: a test of water models.
    Aragones JL, Noya EG, Abascal JL, Vega C.
    J Chem Phys; 2007 Oct 21; 127(15):154518. PubMed ID: 17949184
    [Abstract] [Full Text] [Related]

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