Publicaciones en las que colabora con HEGOI MANZANO MORO (27)

2018

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

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

  2. Cs-137 immobilization in C-S-H gel nanopores

    Physical Chemistry Chemical Physics, Vol. 20, Núm. 14, pp. 9289-9297

  3. Singlet Fission Mediated Photophysics of BODIPY Dimers

    Journal of Physical Chemistry Letters, Vol. 9, Núm. 3, pp. 641-646

  4. Water adsorption on the β-dicalcium silicate surface from DFT simulations

    Minerals, Vol. 8, Núm. 9

2016

  1. Strategies for modulating the luminescence properties of pyronin y dye-clay films: An experimental and theoretical study

    Physical Chemistry Chemical Physics, Vol. 18, Núm. 12, pp. 8730-8738

  2. Unprecedented J-Aggregated Dyes in Pure Organic Solvents

    Advanced Functional Materials, Vol. 26, Núm. 16, pp. 2756-2769

2015

  1. Hydration Mechanism of Reactive and Passive Dicalcium Silicate Polymorphs from Molecular Simulations

    Journal of Physical Chemistry C, Vol. 119, Núm. 34, pp. 19869-19875

  2. Insight on tricalcium silicate hydration and dissolution mechanism from molecular simulations

    ACS Applied Materials and Interfaces, Vol. 7, Núm. 27, pp. 14726-14733

  3. The Role of Water on C-S-H Gel Shear Strength Studied by Molecular Dynamics Simulations

    CONCREEP 10: MECHANICS AND PHYSICS OF CREEP, SHRINKAGE, AND DURABILITY OF CONCRETE AND CONCRETE STRUCTURES