Theoretical investigation of the charge-transfer properties in different meso-linked zinc porphyrins for highly efficient dye-sensitized solar cells

Theoretical investigation of the charge-transfer properties in different meso-linked zinc porphyrins for highly efficient dye-sensitized solar cells

The charge transfer effect of different meso-substituted linkages on porphyrin analogue 1 (A1, B1 and C1) was theoretically investigated using density functional theory (DFT) and time-dependent DFT (TDDFT) calculations. The calculated geometry parameters and natural bond orbital analysis reveal that...

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書目詳細資料
Main Authors:	Supawadee Namuangruk, Kanokkorn Sirithip, Rattanawelee Rattanatwan, Tinnagon Keawin, Nawee Kungwan, Taweesak Sudyodsuk, Vinich Promarak, Yaowarat Surakhot, Siriporn Jungsuttiwong
格式:	雜誌
出版:	2018
主題:	Chemistry
在線閱讀:	https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=84901686897&origin=inward http://cmuir.cmu.ac.th/jspui/handle/6653943832/53352
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