Supporting Information: Molecular doping in the organic semiconductor diindenoperylene: Insights from many-body perturbation theory
Additional details on convergence tests, electronic structure of the isolated molecules and pristine crystals at the mean-field level, geometry optimization and charge population analysis, and results obtained from the PBE0 hybrid functional.
| Autores: | , , , |
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| Tipo de recurso: | conjunto de datos |
| Estado: | Versión publicada |
| Fecha de publicación: | 2023 |
| País: | España |
| Institución: | Consejo Superior de Investigaciones Científicas (CSIC) |
| Repositorio: | DIGITAL.CSIC. Repositorio Institucional del CSIC |
| OAI Identifier: | oai:digital.csic.es:10261/342579 |
| Acceso en línea: | http://hdl.handle.net/10261/342579 |
| Access Level: | acceso abierto |
| Sumario: | Additional details on convergence tests, electronic structure of the isolated molecules and pristine crystals at the mean-field level, geometry optimization and charge population analysis, and results obtained from the PBE0 hybrid functional. |
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