Interfaces of perovskite methylammonium lead iodide with cuprous oxidehttps://doi.org/10.34691/FK2/NYDJ5TCastellanos-Águila, Jesús E.Lodeiro, LucasMenéndez-Proupin, EduardoMontero-Alejo, Ana L.Palacios, PabloConesa, J. C.Wahnón, PerlaRepositorio de datos de investigación de la Universidad de Chile2020-03-112024-01-25T14:09:40ZKey input and output files of quantum mechanical calculations of electronic states of interfaces of Cu2O with CH3NH3PbI3. Coordinate files a supplied for different interface models, as well as input and output files for the VASP package.ChemistryEngineeringPhysicsperovskite solar cellsdensity functional theoryinterfaceshole transport layerAtomic scale model and electronic structure of Cu2O/CH3NH3PbI3 interfaces in perovskite solar cells, ACS Appl. Mater. Interfaces 12, 44648-44657 (2020), doi, 10.1021/acsami.0c11187, https://pubs.acs.org/doi/10.1021/acsami.0c111872020-03-11Menendez, Eduardo2020-03-11CC-BY 4.0