Stochastic cRPA calculations of screened interactions in graphene moire states at high pressures
ORAL
Abstract
In this work [1], we apply the stochastic constrained random phase approximation to study the dynamical renormalization of electronic interactions in twisted bilayer graphene (tBLG) characterized by giant supercells cells with ~9000 electrons. We map the correlated subspace on a model Hamiltonian and study the interplay of screening and the on-site interaction at varying pressure. Our results show a striking difference for pressure dependence of screening compared to the previously computed twist angle dependence.
*This work was supported by the NSF through the Materials Research Science and Engineering Centers (MRSEC) Program through Grant No. DMR-1720256 (Seed Program). In part, this work was supported by the NSF Quantum Foundry through Q-AMASE-i program Award No. DMR-1906325. The calculations were performed as part of the XSEDE computational Project No.~TG-CHE180051. Use was made of computational facilities purchased with funds from the National Science Foundation (CNS-1725797) and administered by the Center for Scientific Computing (CSC). The CSC is supported by the California NanoSystems Institute and the Materials Research Science and Engineering Center (MRSEC; NSF DMR-1720256) at UC Santa Barbara.
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Publication: [1] M. Romanova and V. Vlcek, arXiv:2106.02144
Presenters
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Mariya Romanova
- University of California, Santa Barbara