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148 related items for PubMed ID: 26574249

  • 1. Controlling the long-range corrections in atomistic Monte Carlo simulations of two-phase systems.
    Goujon F, Ghoufi A, Malfreyt P, Tildesley DJ.
    J Chem Theory Comput; 2015 Oct 13; 11(10):4573-85. PubMed ID: 26574249
    [Abstract] [Full Text] [Related]

  • 2. Effect of dispersive long-range corrections to the pressure tensor: the vapour-liquid interfacial properties of the Lennard-Jones system revisited.
    Martínez-Ruiz FJ, Blas FJ, Mendiboure B, Moreno-Ventas Bravo AI.
    J Chem Phys; 2014 Nov 14; 141(18):184701. PubMed ID: 25399153
    [Abstract] [Full Text] [Related]

  • 3. Can we approach the gas-liquid critical point using slab simulations of two coexisting phases?
    Goujon F, Ghoufi A, Malfreyt P, Tildesley DJ.
    J Chem Phys; 2016 Sep 28; 145(12):124702. PubMed ID: 27782674
    [Abstract] [Full Text] [Related]

  • 4. Comparative study of the effect of tail corrections on surface tension determined by molecular simulation.
    Shen VK, Mountain RD, Errington JR.
    J Phys Chem B; 2007 Jun 07; 111(22):6198-207. PubMed ID: 17497915
    [Abstract] [Full Text] [Related]

  • 5. Molecular simulations of the n -alkane liquid-vapor interface: interfacial properties and their long range corrections.
    Ibergay C, Ghoufi A, Goujon F, Ungerer P, Boutin A, Rousseau B, Malfreyt P.
    Phys Rev E Stat Nonlin Soft Matter Phys; 2007 May 07; 75(5 Pt 1):051602. PubMed ID: 17677073
    [Abstract] [Full Text] [Related]

  • 6. Vapor-liquid interfacial properties of rigid-linear Lennard-Jones chains.
    Blas FJ, Moreno-Ventas Bravo AI, Míguez JM, Piñeiro MM, MacDowell LG.
    J Chem Phys; 2012 Aug 28; 137(8):084706. PubMed ID: 22938258
    [Abstract] [Full Text] [Related]

  • 7. Liquid-liquid interfacial properties of a symmetrical Lennard-Jones binary mixture.
    Martínez-Ruiz FJ, Moreno-Ventas Bravo AI, Blas FJ.
    J Chem Phys; 2015 Sep 14; 143(10):104706. PubMed ID: 26374055
    [Abstract] [Full Text] [Related]

  • 8. Calculation of the surface tension from Monte Carlo simulations: does the model impact on the finite-size effects?
    Biscay F, Ghoufi A, Goujon F, Lachet V, Malfreyt P.
    J Chem Phys; 2009 May 14; 130(18):184710. PubMed ID: 19449946
    [Abstract] [Full Text] [Related]

  • 9. Long range corrections in inhomogeneous simulations.
    Janecek J.
    J Phys Chem B; 2006 Mar 30; 110(12):6264-9. PubMed ID: 16553443
    [Abstract] [Full Text] [Related]

  • 10. Properties of Organic Liquids when Simulated with Long-Range Lennard-Jones Interactions.
    Fischer NM, van Maaren PJ, Ditz JC, Yildirim A, van der Spoel D.
    J Chem Theory Comput; 2015 Jul 14; 11(7):2938-44. PubMed ID: 26575731
    [Abstract] [Full Text] [Related]

  • 11. Accurate and precise determination of critical properties from Gibbs ensemble Monte Carlo simulations.
    Dinpajooh M, Bai P, Allan DA, Siepmann JI.
    J Chem Phys; 2015 Sep 21; 143(11):114113. PubMed ID: 26395693
    [Abstract] [Full Text] [Related]

  • 12. Effect of molecular flexibility of Lennard-Jones chains on vapor-liquid interfacial properties.
    Blas FJ, Moreno-Ventas Bravo AI, Algaba J, Martínez-Ruiz FJ, MacDowell LG.
    J Chem Phys; 2014 Mar 21; 140(11):114705. PubMed ID: 24655196
    [Abstract] [Full Text] [Related]

  • 13. Surface tension and long range corrections of cylindrical interfaces.
    Bourasseau E, Malfreyt P, Ghoufi A.
    J Chem Phys; 2015 Dec 21; 143(23):234708. PubMed ID: 26696071
    [Abstract] [Full Text] [Related]

  • 14. Monte Carlo versus molecular dynamics simulations in heterogeneous systems: an application to the n-pentane liquid-vapor interface.
    Goujon F, Malfreyt P, Simon JM, Boutin A, Rousseau B, Fuchs AH.
    J Chem Phys; 2004 Dec 22; 121(24):12559-71. PubMed ID: 15606277
    [Abstract] [Full Text] [Related]

  • 15. Communication: Long range corrections in liquid-vapor interface simulations.
    Lishchuk SV, Fischer J.
    J Chem Phys; 2018 Sep 07; 149(9):091102. PubMed ID: 30195295
    [Abstract] [Full Text] [Related]

  • 16. Influence of the long-range corrections on the interfacial properties of molecular models using Monte Carlo simulation.
    Míguez JM, Piñeiro MM, Blas FJ.
    J Chem Phys; 2013 Jan 21; 138(3):034707. PubMed ID: 23343293
    [Abstract] [Full Text] [Related]

  • 17. Surface tension of fully flexible Lennard-Jones chains: role of long-range corrections.
    MacDowell LG, Blas FJ.
    J Chem Phys; 2009 Aug 21; 131(7):074705. PubMed ID: 19708756
    [Abstract] [Full Text] [Related]

  • 18. Importance of the tail corrections on surface tension of curved liquid-vapor interfaces.
    Ghoufi A, Malfreyt P.
    J Chem Phys; 2017 Feb 28; 146(8):084703. PubMed ID: 28249460
    [Abstract] [Full Text] [Related]

  • 19. Dependence of the liquid-vapor surface tension on the range of interaction: a test of the law of corresponding states.
    Grosfils P, Lutsko JF.
    J Chem Phys; 2009 Feb 07; 130(5):054703. PubMed ID: 19206985
    [Abstract] [Full Text] [Related]

  • 20. Prediction of the temperature dependence of the surface tension of SO2, N2, O2, and Ar by Monte Carlo molecular simulations.
    Neyt JC, Wender A, Lachet V, Malfreyt P.
    J Phys Chem B; 2011 Aug 04; 115(30):9421-30. PubMed ID: 21711018
    [Abstract] [Full Text] [Related]

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