fromage: A library for the study of molecular crystal excited states at the aggregate scale
Rivera, Dommett, Sidat, Rahim, Crespo-Otero, J. Mat. Chem. C, 2020, 8, 2558-2568 [PDF] [Web]
Molecular and Crystalline Requirements for Solid State Fluorescence Exploiting Excited State Intramolecular Proton Transfer
Dommett, Rivera, T.H.Smith, Crespo-Otero, J. Mat. Chem. C, 2020, 8, 2558-2568 [PDF] [Web]
ONIOM(QM:QM′) Electrostatic Embedding Schemes for Photochemistry in Molecular Crystals
Rivera, Dommett, Crespo-Otero, J. Chem. Theory Comput., 2019, 15, 4, 2504-2516 [PDF] [Web]
Water Oxidation Catalysed by Quantum-Sized BiVO4
del Olmo, Dommett, Oevreeide, Walsh, Di Tommaso, Crespo-Otero, J. Mater. Chem. A, 2018, 6, 24965-24970
[PDF] [Web]
How Inter- and Intramolecular Processes Dictate Aggregation-Induced Emission in Crystals Undergoing Excited-State Proton Transfer
Dommett, Rivera, Crespo-Otero, J. Phys. Chem. Lett. 2017, 8, 6148−6153 [PDF] [Web]
Excited state proton transfer in 2′-hydroxychalcone derivatives
Dommett, Crespo-Otero, Phys. Chem. Chem. Phys., 2017, 19, 2409-2416 [PDF] [Web]