Bulletin of the American Physical Society
APS March Meeting 2022
Volume 67, Number 3
Monday–Friday, March 14–18, 2022; Chicago
Session B48: Building the Bridge to Exascale: Applications and Opportunities in Materials, Chemistry, and Biology I
11:30 AM–2:18 PM,
Monday, March 14, 2022
Room: McCormick Place W-471A
Sponsoring
Units:
DCOMP DCP DPOLY DMP
Chair: Jack Deslippe, LBNL
Abstract: B48.00011 : Electronic structure calculations at finite temperature using the piecewise interaction picture density matrix quantum Monte Carlo approach*
1:54 PM–2:06 PM
Presenter:
William Z Van Benschoten
(University of Iowa)
Authors:
William Z Van Benschoten
(University of Iowa)
James J Shepherd
(University of Iowa)
*Research was supported by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences Early Career Research Program (ECRP) under Award Number DE-SC0021317. This research also used resources from the University of Iowa and the resources of the National Energy Research Scientific Computing Center, a DOE Office of Science User Facility supported by the Office of Science of the U.S. Department of Energy under Contract No. DE-AC02-05CH11231 (computer time for calculations only).
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