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Quantum theory calculations (DFT method) of hydrogen-bond charge transfer complex derived from p-phenylenediamine and picric acid to understand the molecular structure from various thermodynamic, electronic, and spectroscopic aspects

Crossref DOI link: https://doi.org/10.1007/s00894-025-06618-y

Published Online: 2026-01-22

Published Print: 2026-02

Update policy: https://doi.org/10.1007/springer_crossmark_policy

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