IÑIGO MARIA LOPEZ ARBELOA-rekin lankidetzan egindako argitalpenak (18)

2019

  1. Distinctive Diffusion Regimes of Organic Molecules in Clays: (De)Coupled Motion with Water

    Journal of Physical Chemistry C, Vol. 123, Núm. 1, pp. 511-516

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

2017

  1. AcetylacetonateBODIPY-Biscyclometalated Iridium(III) Complexes: Effective Strategy towards Smarter Fluorescent Photosensitizer Agents

    Chemistry - A European Journal, Vol. 23, Núm. 42, pp. 10139-10147

  2. Rational Design of Advanced Photosensitizers Based on Orthogonal BODIPY Dimers to Finely Modulate Singlet Oxygen Generation

    Chemistry - A European Journal, Vol. 23, Núm. 20, pp. 4837-4848

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

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

    CONCREEP 2015: Mechanics and Physics of Creep, Shrinkage, and Durability of Concrete and Concrete Structures - Proceedings of the 10th International Conference on Mechanics and Physics of Creep, Shrinkage, and Durability of Concrete and Concrete Structures

2014

  1. Molecular forces governing shear and tensile failure in clay-dye hybrid materials

    Chemistry of Materials, Vol. 26, Núm. 15, pp. 4338-4345

  2. Preparation, photophysical characterization, and modeling of LDS722/Laponite 2D-Ordered hybrid films

    Langmuir, Vol. 30, Núm. 33, pp. 10112-10117

2013

  1. Mechanical behaviour of ordered and disordered calcium silicate hydrates under shear strain studied by atomic scale simulations

    Mechanics and Physics of Creep, Shrinkage, and Durability of Conrete: A Tribute to Zdenek P. Bazant - Proceedings of the 9th Int. Conf. on Creep, Shrinkage, and Durability Mechanics, CONCREEP 2013

  2. Shear deformations in calcium silicate hydrates

    Soft Matter, Vol. 9, Núm. 30, pp. 7333-7341

  3. Ultraviolet-visible dual absorption by single BODIPY dye confined in LTL zeolite nanochannels

    Journal of Physical Chemistry C, Vol. 117, Núm. 25, pp. 13331-13336