https://www.selleckchem.com/pr....oducts/apocynin-acet
This range is an order of magnitude larger than the mean errors of the TDDFT excitation energies. This result suggests that, with currently available functionals, the KS or GKS orbital energies should be treated as intermediate mathematical variables in the calculation of excitation energies rather than as the energies of independent-particle reference states for quasiparticle theory.The neutral or A state of the green fluorescent protein (GFP) chromophore is a remarkable example of a photoacid naturally embedded in the
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