Zinc titanium nitride semiconductor toward durable photoelectrochemical applications AL Greenaway, S Ke, T Culman, KR Talley, JS Mangum, KN Heinselman, ... Journal of the American Chemical Society 144 (30), 13673-13687, 2022 | 25 | 2022 |
First-principles studies of the electronic and optical properties of zinc titanium nitride: the role of cation disorder S Ke, JS Mangum, A Zakutayev, AL Greenaway, JB Neaton Chemistry of Materials 36 (7), 3164-3176, 2024 | 5 | 2024 |
Sn-assisted heteroepitaxy improves ZnTiN 2 photoabsorbers JS Mangum, S Ke, MK Gish, EK Raulerson, CL Perkins, JB Neaton, ... Journal of Materials Chemistry A 12 (8), 4544-4554, 2024 | 1 | 2024 |
Accurate defect electronic structure from non-empirical range-separated hybrid functionals: the case of oxygen vacancies in ZnO S Ke, S Gant, L Kronik, J Neaton Bulletin of the American Physical Society, 2024 | | 2024 |
Towards reliable hybrid functionals for fundamental and optical gaps of surfaces and bulk materials F Sagredo, M Camarasa Gomez, F Ricci, S Ke, L Kronik, J Neaton Bulletin of the American Physical Society, 2024 | | 2024 |
Automated Workflow for High-Throughput Calculations of Band Gaps with a Wannier-localized Optimally-Tuned Screened Range-Separated Hybrid Functional F Ricci, S Gant, F Sagredo, S Ke, G Ohad, L Kronik, J Neaton APS March Meeting Abstracts 2024, B60. 010, 2024 | | 2024 |
First-principles studies of the role of cation disorder on electronic structure of ZnTiN2 S Ke, J Neaton APS March Meeting Abstracts 2023, G41. 004, 2023 | | 2023 |
First-principles studies of the role of stoichiometry on electronic structure of BaBi1 - xPbxO3 S Ke, J Haber, J Neaton APS March Meeting Abstracts 2022, Q53. 005, 2022 | | 2022 |