Intersite Coulomb Interactions in Charge Ordered Systems

التفاصيل البيبلوغرافية
العنوان: Intersite Coulomb Interactions in Charge Ordered Systems
المؤلفون: Jang, Bo Gyu, Kim, Minjae, Lee, Sang-Hoon, Yang, Wooil, Jhi, Seung-Hoon, Son, Young-Woo
المصدر: Phys. Rev. Lett. 130, 136401 (2023)
سنة النشر: 2022
المجموعة: Condensed Matter
مصطلحات موضوعية: Condensed Matter - Strongly Correlated Electrons, Condensed Matter - Mesoscale and Nanoscale Physics
الوصف: Using {\it ab initio} approaches for extended Hubbard interactions coupled to phonons, we reveal that the intersite Coulomb interaction plays important roles in determining various distinctive phases of the paradigmatic charge ordered materials of Ba$_{1-x}$K$_x A$O$_3$ ($A=$ Bi and Sb). We demonstrated that all their salient doping dependent experiment features such as breathing instabilities, anomalous phonon dispersions, and transition between charge-density wave and superconducting states can be accounted very well if self-consistently obtained nearest neighbor Hubbard interaction are included, thus establishing a minimal criterion for reliable descriptions of spontaneous charge orders in solids.
Comment: 4 pages, 2 additional pages for references and 4 pages supplementary materials, title and abstract are modified
نوع الوثيقة: Working Paper
DOI: 10.1103/PhysRevLett.130.136401
URL الوصول: http://arxiv.org/abs/2205.02470
رقم الأكسشن: edsarx.2205.02470
قاعدة البيانات: arXiv
الوصف
DOI:10.1103/PhysRevLett.130.136401