Influence of phenyl-attached substituents on the vibrational and electronic spectra of meso-tetraphenylporphyrin: A DFT study
© 2015 Elsevier B.V. The effects of substituents attached to phenyl groups of free base meso-tetraphenylporphyrin (H2TPP) on its geometrical structure, vibrational spectra and electronic spectra of H2TPP derivatives namely FB1-8 are predicted by the density functional theory (DFT) and time-dependent...
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Main Authors: | Ngaojampa,C., Namuangruk,S., Surakhot,Y., Promarak,V., Jungsuttiwong,S., Kungwan,N. |
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Format: | Article |
Published: |
Elsevier BV
2015
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Subjects: | |
Online Access: | http://www.scopus.com/inward/record.url?partnerID=HzOxMe3b&scp=84926443732&origin=inward http://cmuir.cmu.ac.th/handle/6653943832/38919 |
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Institution: | Chiang Mai University |
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