Publications by the researcher in collaboration with HEGOI MANZANO MORO (5)

2024

  1. pyCSH: Automated atomic-level structure generation of bulk C-S-H and investigation of their intrinsic properties

    Cement and Concrete Research, Vol. 183

2023

  1. Multi-step nucleation pathway of C-S-H during cement hydration from atomistic simulations

    Nature Communications, Vol. 14, Núm. 1

  2. ænet-PyTorch: A GPU-supported implementation for machine learning atomic potentials training

    The Journal of chemical physics, Vol. 158, Núm. 16

2022

  1. A potential C-S-H nucleation mechanism: atomistic simulations of the portlandite to C-S-H transformation

    Cement and Concrete Research, Vol. 162

2021

  1. Relationship between Atomic Structure, Composition, and Dielectric Constant in Zr-SiO2Glasses

    ACS Omega, Vol. 6, Núm. 43, pp. 28561-28568