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Evolutionary chemical space exploration for functional materials: computational organic semiconductor discovery
Computational methods, including crystal structure and property prediction, have the potential to accelerate the materials discovery process by enabling structure prediction and screening of possible molecular building blocks prior to their synthesis. However, the discovery of new functional molecul...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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The Royal Society of Chemistry
2020
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8159259/ https://www.ncbi.nlm.nih.gov/pubmed/34122948 http://dx.doi.org/10.1039/d0sc00554a |