@article{chizallet:hal-02872184, TITLE = {{Towards the Atomic Scale Simulation of Intricate Acidic Aluminosilicate Catalysts}}, AUTHOR = {Chizallet, C{\'e}line}, URL = {https://ifp.hal.science/hal-02872184}, JOURNAL = {{ACS Catalysis}}, PUBLISHER = {{American Chemical Society}}, VOLUME = {10}, NUMBER = {10}, PAGES = {5579-5601}, YEAR = {2020}, MONTH = May, DOI = {10.1021/acscatal.0c01136}, KEYWORDS = {Zeolite ; Dealumination ; External Surface ; Amorphous Silica--Alumina ; Br{{\o}}nsted Acid Sites ; Lewis Acid Sites ; Density Fonctional Theory}, PDF = {https://ifp.hal.science/hal-02872184/file/Toward%20the%20Atomic%20Scale.pdf}, HAL_ID = {hal-02872184}, HAL_VERSION = {v1}, }