Bulletin of the American Physical Society
APS March Meeting 2024
Monday–Friday, March 4–8, 2024; Minneapolis & Virtual
Session B58: Electrons, Phonons, Electron-Phonon Scattering, and Phononics I
11:30 AM–2:30 PM,
Monday, March 4, 2024
Room: 205D
Sponsoring
Unit:
DCOMP
Chair: Zhenglu Li, University of Southern California
Abstract: B58.00012 : First-principles derivation of elastic interaction between Jahn-Teller centers in crystals via static lattice Green's functions*
2:06 PM–2:18 PM
Presenter:
Zhishuo Huang
(Department of Chemistry, National University of Singapore, Block S8 Level 3, 3 Science Drive 3, Singapore 117543, Singapore)
Authors:
Zhishuo Huang
(Department of Chemistry, National University of Singapore, Block S8 Level 3, 3 Science Drive 3, Singapore 117543, Singapore)
Naoya Iwahara
(Graduate School of Engineering, Chiba University, 1-33 Yayoi-cho, Inage-ku, Chiba 263-8522, Japan)
Liviu Cibotaru
(Theory of Nanomaterials Group, KU Leuven, Celestijnenlaan 200F, B-3001 Leuven, Belgium)
[1]. Z. Huang, M. D. Albaqami, T. Sato, N. Iwahara and L. F. Chibotaru, Phys. Rev. B 103(13), 134102 (2021)
*Z.H. acknowledges the financial support of the research projects A-800079-00-00 and A-8000017-00-00 of the National University of Singapore. N.I. acknowledges the Grant-in-Aid for Scientific Research (Grant No. 22K03507) from the Japan Society for the Promotion of Science.The computational resources and services used in this work were provided by the VSC (Flemish Supercomputer Center) funded by the Research Foundation - Flanders (FWO) and the Flemish Government - department EWI.
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