TY  - JOUR 
AU  - Phan, Brandon
AU  - Ramprasad, Rampi
AU  - González del Río, Beatriz
PY  - 2023
UR  - https://uvadoc.uva.es/handle/10324/73979
AB  - Density functional theory (DFT) has been a critical component of computational materials research and discovery for decades. However, the computational cost of solving the central Kohn–Sham equation remains a major obstacle for dynamical studies of...
LA  - eng
PB  - NATURE PORTFOLIO
TI  - A deep learning framework to emulate density functional theory
DO  - 10.1038/s41524-023-01115-3
ER  -