Propionic-acid-terminated silicon quantum

Propionic-Acid-Terminated Silicon Quantum Dots... [Pg.34]

Fig. 3.2 (a) —HOMO energy (ionization potential) and (b) —LUMO energy (electron affinity) for SiQDs in ground-state (SO) or excited-state (SI) configuration (see text) as a function of the adsorbed PA number [22]. Reprinted with permission from (Li QS, Zhang RQ, Niehaus TA, Frauenheim T, Lee ST (2007) Theoretical studies on optical and electronic properties of propionic-acid-terminated silicon quantum dots, J Chem Theory Comput 3 1518-1526). Copyright (2007), American Chemical Society... [Pg.36]

Li QS, Zhang RQ, Niehaus TA, Frauenheim T, Lee ST (2007) Theoretical studies on optical and electronic properties of propionic-acid-terminated silicon quantum dots. 1 Chem Theory Comput 3 1518-1526... [Pg.51]

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