6 papers
Towards the discovery of high critical magnetic field superconductors
Benjamin Geisler, Philip M. Dee, James J. Hamlin +3
Superconducting materials are of significant technological relevance for a broad range of applications, and intense research efforts aim at enhancing the critical temperature $T_{c…
Guided Diffusion for the Discovery of New Superconductors
Pawan Prakash, Jason B. Gibson, Zhongwei Li +13
The inverse design of materials with specific desired properties, such as high-temperature superconductivity, represents a formidable challenge in materials science due to the vast…
Developing a Complete AI-Accelerated Workflow for Superconductor Discovery
Jason B. Gibson, Ajinkya C. Hire, Pawan Prakash +8
The quest to identify new superconducting materials with enhanced properties is hindered by the prohibitive cost of computing electron-phonon spectral functions, severely limiting…
Fermi surface reconstruction and enhanced spin fluctuations in strained LaNiO on LaAlO(001) and SrTiO(001)
Benjamin Geisler, James J. Hamlin, Gregory R. Stewart +2
We explore the structural and electronic properties of the bilayer nickelate La3Ni2O7 on LaAlO3(001) and SrTiO3(001) by using density functional theory including a Coulomb repulsio…
Novel electronic state of honeycomb iridate CuIrO at high pressure
G. Fabbris, E. H. T. Poldi, S. Sinha +15
CuIrO has attracted recent interest due to its proximity to the Kitaev quantum spin liquid state and the complex structural response observed at high pressures. We use x-ra…
Superconductivity in WBe2
J. S. Kim, P. M. Dee, J. J. Hamlin +2
WBe2, which occurs in space group 194, with hexagonal symmetry P63/mmc, is prepared by arc-melting at temperatures above 2200 C, where Be vapor loss is significant. This study is m…