Showing 1–20 of 24 results
/ Date/ Name
Mar 1, 2021Rapid Recombination by Cadmium Vacancies in CdTeFeb 24, 2022Impact of metastable defect structures on carrier recombination in solar cellsJul 20, 2022Identifying the ground state structures of point defects in solidsApr 22, 2026Accelerating point defect simulations using data-driven and machine learning approachesNov 4, 2020Solvent Engineered Synthesis of Layered SnO Nanoparticles for High-Performance AnodesFeb 6, 2024Upper efficiency limit of Sb2Se3 solar cellsDec 26, 2024Identifying Split Vacancy Defects with Machine-Learned Foundation Models and ElectrostaticsMar 12, 2024doped: Python toolkit for robust and repeatable charged defect supercell calculationsAug 20, 2020Perovskite-Inspired Materials for Photovoltaics -- From Design to DevicesApr 22, 2025High-performance training and inference for deep equivariant interatomic potentialsJul 19, 2023Imperfections are not 0 K: free energy of point defects in crystalsJun 30, 2022Band Versus Polaron: Charge Transport in Antimony ChalcogenidesFeb 9, 2023Four-electron Negative-U Vacancy Defects in Antimony SelenideApr 29, 2022Band gap opening from displacive instabilities in layered covalent-organic frameworks $^†$Jan 22, 2024Machine-learning structural reconstructions for accelerated point defect calculationsMar 29, 2022Orbital-selective Band Hybridisation at the Charge Density Wave Transition in Monolayer TiTe$_2$Jul 1, 2020Bandgap Lowering in Mixed Alloys of Cs2Ag(SbxBi1-x)Br6 Double Perovskite Thin FilmsDec 1, 2025Defect-Limited Efficiency of Pnictogen Chalcohalide Solar CellsJan 4, 2024Factors Enabling Delocalized Charge-Carriers in Pnictogen-Based Solar Absorbers: In-depth Investigation into CuSbSe2Feb 23, 2026Band-Like Transport and Cation Off-Centring in Ag/Bi-Based Solar Absorbers