Bulletin of the American Physical Society
APS March Meeting 2020
Volume 65, Number 1
Monday–Friday, March 2–6, 2020; Denver, Colorado
Session B58: DFT and Beyond II
11:15 AM–1:39 PM,
Monday, March 2, 2020
Room: Mile High Ballroom 3B
Sponsoring
Units:
DCP DCOMP DPOLY DCMP
Chair: Adam Wasserman, Purdue Univ
Abstract: B58.00004 : Constrained Machine Learning de-orbitalization of meta-GGA exchange-correlation functionals*
Presenter:
Kanun Pokharel
(Tulane Univ)
Authors:
Kanun Pokharel
(Tulane Univ)
James Furness
(Tulane Univ)
Jianwei Sun
(Tulane Univ)
[1] Jianwei Sun et.al. Phys. Rev. Lett. 115,036402 (2015)
[2] Mejia-Rodriguez et.al. Phys. Rev. A 96, 052512 (2017)
*DOE #DE-SC0019350
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