Table 2. Summary of the Results from the Characterization of the PbS Nanoparticles Synthesized with Different Capping Ligandsa.
| system | size (nm) | onsetred (V) | onsetoxi (V) | Egechem (eV) | Abs λmax, (nm) | Egopt (eV) | Eg(EELS) (eV) | CB LUMO (eV) | VB HOMO (eV) |
|---|---|---|---|---|---|---|---|---|---|
| PbS-OA | 4.18 | –2.04 | –0.30 | 1.76 | 1000 | 1.11 | 1.35 | 3.06 | 4.24 |
| 5.32 | –1.87 | 0.05 | 1.92 | 1095 | 1.07 | 3.23 | 4.36 | ||
| 5.97 | –1.86 | –0.11 | 1.75 | 1222 | 0.95 | 3.24 | 4.24 | ||
| 6.27 | –1.88 | –0.11 | 1.77 | 1285 | 0.89 | 3.22 | 4.16 | ||
| 6.73 | –1.71 | 0.12 | 1.83 | 1368 | 0.842 | 3.39 | 4.28 | ||
| PbS-MA | 2.94 | –2.03 | –0.10 | 1.93 | 779 | 1.30 | 1.5 | 3.07 | 4.47 |
| 3.64 | –2.11 | –0.16 | 1.95 | 1029 | 1.046 | 2.99 | 4.12 | ||
| 3.83 | –2.13 | –0.19 | 1.94 | 1049 | 1.054 | 2.97 | 4.10 | ||
| 4.08 | –2.14 | –0.08 | 2.06 | 1166 | 0.96 | 2.96 | 3.99 | ||
| 5.33 | –2.24 | –0.13 | 2.11 | 1400 | 0.79 | 2.86 | 3.71 | ||
| PbS-HA | 4.03 | –2.07 | –0.12 | 1.95 | 817 | 1.20 | 3.03 | 4.30 | |
| 5.05 | –2.08 | –0.10 | 1.98 | 1285 | 0.80 | 3.02 | 3.88 |
Reduction and oxidation onsets with
respect to ferrocene (Fc) used as an internal standard. Egechem = electrochemical
band gap, Abs = maximum value of the first optical absorption peak, Eg = optical band gap, and Eg(EELS) = band
gap calculated through EELS. HOMO and LUMO are calculated on an absolute
energy scale using the following equations:
(3)20 and
(4)10