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Nanomaterials | Free Full-Text | Functional Group Effects on the HOMO–LUMO Gap of g-C3N4
An unusual mechanism for HOMO–LUMO gap narrowing in a minimal near-IR dye generated by the deprotonation of bis(dicyanomethylene)indan - ScienceDirect
What is the HOMO - LUMO gap and how does it change the properties of a substance?
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Density functional theory studies on molecular geometry, spectroscopy, HOMO– LUMO and reactivity descriptors of titanium(IV) and oxidozirconium(IV) complexes of phenylacetohydroxamic acid - Choudhary - 2022 - Journal of Computational Chemistry - Wiley ...
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