Publicaciones en colaboración con investigadoras/es de Donostia International Physics Center (12)

2021

  1. A dissolution model of alite coupling surface topography and ions transport under different hydrodynamics conditions at microscale

    Cement and Concrete Research, Vol. 142

  2. New Kinetic Monte Carlo Model to Study the Dissolution of Quartz

    ACS Earth and Space Chemistry, Vol. 5, Núm. 3, pp. 516-524

2020

  1. Kimera: A kinetic montecarlo code for mineral dissolution

    Minerals, Vol. 10, Núm. 9, pp. 1-17

2019

  1. Mechanisms and Dynamics of Mineral Dissolution: A New Kinetic Monte Carlo Model

    Advanced Theory and Simulations, Vol. 2, Núm. 10

2018

  1. Benchmark of ReaxFF force field for subcritical and supercritical water

    Journal of Chemical Physics, Vol. 148, Núm. 23

2015

  1. Effect of chemical environment on the dynamics of water confined in calcium silicate minerals: Natural and synthetic tobermorite

    Langmuir, Vol. 31, Núm. 17, pp. 4964-4972

2012

  1. Do cement nanotubes exist?

    Advanced Materials, Vol. 24, Núm. 24, pp. 3239-3245

  2. Ettringite strengthening at high pressures induced by the densification of the hydrogen bond network

    Journal of Physical Chemistry C, Vol. 116, Núm. 30, pp. 16138-16143

2009

  1. Elastic properties of the main species present in Portland cement pastes

    Acta Materialia, Vol. 57, Núm. 5, pp. 1666-1674

  2. Structural, mechanical, and reactivity properties of tricalcium aluminate using first-principles calculations

    Journal of the American Ceramic Society, Vol. 92, Núm. 4, pp. 897-902

2007

  1. Mechanical properties of crystalline calcium-silicate-hydrates: Comparison with cementitious C-S-H gels

    Physica Status Solidi (A) Applications and Materials Science

  2. On the formation of cementitious C-S-H nanoparticles

    Journal of Computer-Aided Materials Design