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Are Fully-Conjugated Expanded Indenofluorenes Analogues and Diindeno[n]thiophene Derivatives Diradicals? A Simplified (Spin-Flip) Time-Dependent Density Functional Theory [(SF-)sTD-DFT] Study

Are Fully-Conjugated Expanded Indenofluorenes Analogues and Diindeno[n]thiophene Derivatives Diradicals? A Simplified (Spin-Flip) Time-Dependent Density Functional Theory [(SF-)sTD-DFT] Study

de Wergifosse, Marc; Seibert, Jakob; Champagne, Benoît; Grimme, Stefan

期刊名称The Journal of Physical Chemistry A
作者de Wergifosse, Marc; Seibert, Jakob; Champagne, Benoît; Grimme, Stefan
印刷ISSN1089-5639
电子ISSN1520-5215
文件大小5089.98KB
发表时间2019-10-21
DOI10.1021/acs.jpca.9b08474

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