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Christopher Renskers

Publications and source records attributed to Christopher Renskers.

3 recordsLinked to original sources

Quasiparticle GW for Superconductors: Toward a Unified Treatment of Electron-Phonon and Electron-Plasmon Couplings

Superconducting two-dimensional materials, and in particular few-layer graphene, offer an exciting platform for low-power electronics, yet the origin of their unconventional superconductivity remains an open question. Prevailing theories, primarily rooted in the Bardeen-Cooper-Schrieffer (BCS) framework that assumes electron-phonon interactions are the main mechanism of superconductivity, struggle to account quantitatively for the observed phenomena. Recent studies point to a plasmonic pairing mechanism in graphene systems; however, disentangling the relative contributions of phonon- and plasmon-mediated pairing remains challenging due to the lack of a satisfactory first-principles framework capable of accurately capturing dynamical screening effects in the electronic channel. Here, we present a new theoretical framework that extends the quasiparticle self-consistent GW method to the superconducting phase by coupling it with the Eliashberg treatment of both phonon- and plasmon-mediated interactions. Our approach, termed superconducting quasiparticle GW (s-qpGW), is on par with the state-of-the-art Eliashberg theory of superconductivity when applied to bulk metals, and correctly predicts the absence of superconductivity in doped monolayer graphene. To differentiate s-qpGW from conventional Eliashberg approaches, we study a simple model system, graphene with an artificially enhanced density of states, and demonstrate that s-qpGW captures dynamical Coulomb screening effects in ways that standard BCS theory cannot.

cond-mat.supr-con

First-principles design of ambient-pressure Mg$_x$B$_2$C$_2$ and Na$_x$BC superconductors

We employ ab initio modeling to investigate the possibility of attaining high-temperature conventional superconductivity in ambient-pressure materials based on the known MgB$_2$C$_2$ and recently proposed thermodynamically stable NaBC ternary compounds. The constructed $(T,P_M)$ phase diagrams (M = Mg or Na) indicate that these layered metal borocarbides can be hole-doped via thermal deintercalation that has been successfully used in previous experiments to produce Li$_y$BC ($y=1>x\gtrsim0.5$) samples. The relatively low temperature threshold required to trigger NaBC desodiation may help prevent the formation of defects shown recently to be detrimental to the electron-phonon coupling in the delithiated LiBC analog. According to our numerical solutions of the anisotropic full-bandwidth Migdal-Eliashberg equations, the proposed Mg$_x$B$_2$C$_2$ and Na$_x$BC materials exhibit superconducting critical temperatures between 43 K and 84 K. At the same time, we demonstrate that buckling of defect-free honeycomb BC layers, favored in heavily-doped Na$_x$BC compounds, can substantially reduce or effectively suppress the materials' potential for MgB$_2$-type superconductivity.

cond-mat.supr-con

BCS superconductivity in ionic hydrides using chemical capacitor setup

We apply a novel chemical capacitor setup to facilitate metallization of ionic hydrides, LiH and MgH2. It turns out that the amount of holes doped to a single layer of these materials may reach 0.72 per H atom without structure collapse; concomitant maximum TC values exceed 17 K in the absence of external pressure for 0.31-hole-doped LiH supported on the LiBaF3 perovskite.

cond-mat.supr-con