Ab initio MO study of m-phenylenediamine and 2,4-diamino-1,3,5-triazine dication diradicals
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OpenAlex topics: Magnetism in coordination complexes · Organic Light-Emitting Diodes Research · Molecular Junctions and Nanostructures
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References (21)
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19. In all the DFT calculations, the 〈s2〉 values were nearly 2.
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