Determining the Informatics and Conceptual DFT Study of Pigments Derived from Carotenoids of Marine Origin
The goal of this study was to evaluate the behaviour of five density functionals, CAM-B3LYP, LC-HPBE, MN12SX, N12SX, and B97XD, when used in conjunction with the Def2TZVP basis set and the SMD solvation model to calculate the molecular properties, chemical
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