Bulletin of the American Physical Society
APS March Meeting 2024
Monday–Friday, March 4–8, 2024; Minneapolis & Virtual
Session N58: Quantum Embedding Methods: Materials
11:30 AM–1:42 PM,
Wednesday, March 6, 2024
Room: 205D
Sponsoring
Unit:
DCOMP
Chair: Malte Rösner
Abstract: N58.00002 : Self-consistent quantum defect embedding theory*
11:42 AM–11:54 AM
Presenter:
Siyuan Chen
(University of Chicago)
Authors:
Siyuan Chen
(University of Chicago)
Marco Govoni
(University of Modena and Reggio Emilia)
Giulia Galli
(University of Chicago)
[1] H. Ma, M. Govoni, and G. Galli, npj Comput. Mater. 6, 85 (2020).
[2] N. Sheng et al., J. Chem. Theory Comput. 18, 3512 (2022).
[3] C. Vorwerk et al., Nat. Comput. Sci. 2, 424 (2022).
*This work was supported by the Midwest Integrated Center for Computational Materials (MICCoM) as part of the Computational Materials Sciences Program funded by the U.S. Department of Energy.
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