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Qualitatively Incorrect Features in the TDDFT Spectrum of Thiophene-Based Compounds
[Image: see text] Ab initio molecular electronic structure computations of thiophene-based compounds constitute an active field of research prompted by the growing interest in low-cost materials for organic electronic devices. In particular, the modeling of electronically excited states and other ti...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical
Society
2014
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4598019/ https://www.ncbi.nlm.nih.gov/pubmed/26263085 http://dx.doi.org/10.1021/jz5022087 |