@article{claverie:hal-03557298,
TITLE = {Assessment of the reactivity and hydration of Portland cement clinker phases from atomistic simulation: A critical review},
AUTHOR = {Claverie, J. and Wang, Q. and Kamali-Bernard, Siham and Bernard, Fabrice},
URL = {https://hal.science/hal-03557298},
JOURNAL = {Cement and Concrete Research},
PUBLISHER = {Elsevier},
VOLUME = {154},
PAGES = {106711},
YEAR = {2022},
MONTH = Apr, DOI = {10.1016/j.cemconres.2022.106711},
KEYWORDS = {Density functional theory ; Dicalcium silicate ; Electronic structure ; Hydration ; Molecular dynamics ; Portland cement ; Reactivity ; Surface energy ; Tricalcium silicate ; Atomistic simulation ; Cleavage energy ; Clinker},
PDF = {https://hal.science/hal-03557298/file/review_hydration.pdf},
HAL_ID = {hal-03557298},
HAL_VERSION = {v1},
}