Comparative quantum chemical and spectral characterization of meso-tetra(4-sulfonatophenyl) porphine forms as seeds for J- and H-aggregates

Aggregation of 5,10,15,20-tetrakis(4-sulfonatophenyl) porphyrin (TPPS4) molecules as a function of solvent pH is a complex process because of the co-existence of many possible interacting monomeric ionic forms that self-assemble into various aggregate structures. Possible seeding elements of aggrega...

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Bibliographic Details
Main Authors: Laura Baliulyte, Darius Abramavicius, Saulius Bagdonas, Agne Kalnaityte, Vilius Poderys, Ricardas Rotomskis, Virginijus Barzda
Format: Article
Language:English
Published: AIP Publishing LLC 2023-10-01
Series:AIP Advances
Online Access:http://dx.doi.org/10.1063/5.0167120