Publications en collaboration avec des chercheurs de Instituto de Química Física Rocasolano (21)

2023

  1. Fluids meet solids

    Journal of Chemical Physics

2014

  1. Nucleation free-energy barriers with Hybrid Monte-Carlo/Umbrella Sampling

    Physical Chemistry Chemical Physics, Vol. 16, Núm. 45, pp. 24913-24919

2010

  1. Heat capacity of water: A signature of nuclear quantum effects

    Journal of Chemical Physics

2005

  1. Can simple models describe the phase diagram of water?

    Journal of Physics Condensed Matter, Vol. 17, Núm. 45

2002

  1. Study of the triplet and pair structure of strong electrolytes modeled via truncated Coulomb interactions

    Journal of Chemical Physics, Vol. 117, Núm. 8, pp. 3763-3771

  2. Theory and simulation of the triplet structure factor and triplet direct correlation functions in binary mixtures

    Journal of Chemical Physics, Vol. 116, Núm. 2, pp. 730-736

2001

  1. Inhomogeneous integral equation for the triplet structure of binary liquids

    Journal of Chemical Physics, Vol. 114, Núm. 8, pp. 3562-3569

2000

  1. On the triplet structure of binary liquids

    Journal of Chemical Physics, Vol. 113, Núm. 8, pp. 3302-3309

1997

  1. Influence of association on the liquid-vapor phase coexistence of simple systems

    Journal of Chemical Physics, Vol. 106, Núm. 4, pp. 1569-1575

1996

  1. Fluid-solid equilibrium of a charged hard-sphere model

    Physical Review E - Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics, Vol. 54, Núm. 3, pp. 2746-2760

  2. Theory and simulation of central force model potentials: Application to homonuclear diatomic molecules

    Journal of Chemical Physics, Vol. 105, Núm. 22, pp. 10008-10021

1995

  1. Monte Carlo simulation and integral-equation studies of a fluid of charged hard spheres near the critical region

    Physical Review E, Vol. 51, Núm. 1, pp. 289-296

1989

  1. Background and bridge functions for the homonuclear hard diatomic fluid

    The Journal of Chemical Physics, Vol. 90, Núm. 12, pp. 7330-7337

  2. New aspects in the simulation and behaviour of polar molecular fluids

    Molecular Physics, Vol. 68, Núm. 5, pp. 1067-1078

  3. The solution of the reference hypernetted chain equation for the dipolar hard diatomic fluid

    The Journal of Chemical Physics, Vol. 91, Núm. 4, pp. 2581-2586

  4. Thermodynamics of a quadrupolar hard diatomic fluid using a perturbation theory with nonspherical reference system

    Journal of Physical Chemistry, Vol. 93, Núm. 11, pp. 4636-4642

1987

  1. Extension of the optimized RHNC equation to multicomponent liquids

    The Journal of Chemical Physics, Vol. 87, Núm. 4, pp. 2249-2256

1985

  1. A unified treatment of the equation of state of hard linear bodies

    Journal of Molecular Liquids, Vol. 30, Núm. 2, pp. 133-137

  2. MC test of perturbation theories based on site-site potentials

    The Journal of Chemical Physics, Vol. 82, Núm. 5, pp. 2445-2452

1982

  1. Thermodynamic properties of nitrogen from a perturbation theory for ISM fluids

    Chemical Physics Letters, Vol. 85, Núm. 1, pp. 117-119