Inconsistency between molecular structure and energy affecting the dipolar strength between electronic states: a probe into unique inter functional correlations among CAM-B3LYP, LC-$$\omega$$HPBE, $$\omega$$-B97XD functionals
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Publisher
Springer Science and Business Media LLC
Link
https://link.springer.com/content/pdf/10.1007/s12039-024-02255-9.pdf
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4. Migliore A 2019 How To Extract Quantitative Information on Electronic Transitions from the Density Functional Theory Black Box J. Chem. Theory Comput. 15 4915
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