Showing results (21-30 of 24) with videos related to
Sort By:
Pageof 3
You have reached the last page of results.This site can display upto 24 results.
Journal of Computational Chemistry|May 19, 2021
Hybrid localized graph kernel for machine learning energy-related properties of molecules and solidsBastien Casier, Mauricio Chagas da Silva, Michael Badawi, et al.Journal of the American Chemical Society|August 28, 2007
Structure, vibrational analysis, and insights into host-guest interactions in as-synthesized pure silica ITQ-12 zeolite by periodic B3LYP calculationsClaudio Marcelo Zicovich-Wilson, María Luisa San-Román, Miguel Angel Camblor, et al.Journal of Chemical Theory and Computation|February 22, 2022
Assessing the Accuracy of Machine Learning Thermodynamic Perturbation Theory: Density Functional Theory and BeyondBasile Herzog, Maurício Chagas da Silva, Bastien Casier, et al.The Journal of Chemical Physics|June 4, 2020
The CRYSTAL code, 1976-2020 and beyond, a long storyRoberto Dovesi, Fabien Pascale, Bartolomeo Civalleri, et al.Pageof 3