5 papers
Delafossites as an unexpected competing phase to infinite-layer oxides
Armin Sahinovic, Benjamin Geisler, Rossitza Pentcheva
Motivated by the discovery of superconductivity in Sr-doped infinite-layer nickelate films on SrTiO(001), we explore the broader landscape of O oxides through comprehen…
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…