Stochastic cRPA calculations of screened interactions in graphene moire states at high pressures

ORAL

Abstract

Twisted bilayer graphene (tBLG) hosts correlated electrons in flat bands, stemming from the coupling between mutually rotated monolayers. The coupling is primarily controlled by the twist angle but equally well by the bilayer’s in-plane strain or compression. It was found previously that under angle twist screening plays a crucial role in reducing bare Coulomb interactions as one approaches the magic angle. The pressure behavior of screening is however less investigated.

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.

Publication: [1] M. Romanova and V. Vlcek, arXiv:2106.02144

Presenters

  • Mariya Romanova

    • University of California, Santa Barbara

Authors

  • Mariya Romanova

    • University of California, Santa Barbara
  • Vojtech Vlcek

    • University of California, Santa Barbara