Bulletin of the American Physical Society
APS March Meeting 2021
Volume 66, Number 1
Monday–Friday, March 15–19, 2021; Virtual; Time Zone: Central Daylight Time, USA
Session C19: Density Functional Theory and Beyond I
3:00 PM–6:00 PM,
Monday, March 15, 2021
Sponsoring
Units:
DCOMP DCP DCMP DPOLY
Chair: James Furness, Tulane Univ
Abstract: C19.00003 : Kinetic energy density using machine learning for orbital-free density functional calculations
3:24 PM–3:36 PM
Live
Presenter:
Fahhad Alharbi
(King Fahd Univ KFUPM)
Authors:
Mohammed Al Ghadeer
(King Fahd Univ KFUPM)
Abdulaziz Al-Aswad
(King Fahd Univ KFUPM)
Fahhad Alharbi
(King Fahd Univ KFUPM)
Collaboration:
Orbital-free density functional theory by machine learning
[1] F. H. Alharbi and S. Kais, Int. J. Quantum Chem. 117, 25373 (2017).
[2] T. Gal and A. Nagy, J. Mol. Struct. 501-502, 167 (2000).
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