[AMD]

Journal of the American Chemical Society 145, 20073 (2023)

Polymer vesicles with integrated photothermal responsiveness

Submitted (2023) – Pre-print on ChemRxiv

RedPred, a machine learning model for the prediction of redox reaction energies of the aqueous organic electrolytes

Submitted (2023)

ML-aided computational screening of 2D materials for photocatalytic water splitting

Digital Discovery 2, 1016 (2023)

Discovery of lead quinone cathode materials for Li-ion batteries

Energy Advances 2, 820 (2023)

Virtual screening of organic quinones as cathode materials for sodium-ion batteries

Scientific Data 9, 718 (2022)

RedDB, a computational database of electroactive molecules for aqueous redox flow batteries

Journal of Materials Chemistry A 10, 22214 (2022)

Discovery of aza-aromatic anolytes for aqueous redox flow batteries via high-throughput screening

Nature Catalysis 5, 222 (2022)

Potassium hydride-intercalated graphite as an efficient heterogeneous catalyst for ammonia synthesis