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cond-mat.supr-con2022★ 68 cited
High-Throughput DFT-Based Discovery of Next Generation Two-Dimensional (2D) Superconductors
Daniel Wines, Kamal Choudhary, Adam J. Biacchi +2
High-throughput density functional theory (DFT) calculations allow for a systematic search for conventional superconductors. With the recent interest in two-dimensional (2D) superc…
cond-mat.supr-con2022★ 78 cited
Designing High-Tc Superconductors with BCS-inspired Screening, Density Functional Theory and Deep-learning
Kamal Choudhary, Kevin Garrity
We develop a multi-step workflow for the discovery of conventional superconductors, starting with a Bardeen Cooper Schrieffer inspired pre-screening of 1736 materials with high Deb…