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Electronically Excited States in Poly(p-phenylenevinylene): Vertical Excitations and Torsional Potentials from High-Level Ab Initio Calculations
[Image: see text] Ab initio second-order algebraic diagrammatic construction (ADC(2)) calculations using the resolution of the identity (RI) method have been performed on poly-(p-phenylenevinylene) (PPV) oligomers with chain lengths up to eight phenyl rings. Vertical excitation energies for the four...
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| Hlavní autoři: | , , , , |
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| Médium: | Artigo |
| Jazyk: | Inglês |
| Vydáno: |
American Chemical Society
2013
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| On-line přístup: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3598239/ https://ncbi.nlm.nih.gov/pubmed/23427902 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp400372t |
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