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. 2020 Feb 28;5(9):4689–4696. doi: 10.1021/acsomega.0c00223

Table 3. Electrochemical Properties Data and Molecular Energy Levels of PTK, PBTK, and PFTK.

polymer E1/2red (V) LUMO (eV)a HOMO (eV)b LUMO (eV)c HOMO (eV)c
PTK –1.81 –2.99 –5.50 –2.91 –6.30
PBTK –1.76 –3.04 –5.34 –3.19 –6.26
PFTK –1.86 –2.94 –5.30 –2.89 –5.91
a

Calculated from CV: ELUMO = −(4.80 + E1/2red) eV.

b

Calculated from ELUMO and Egopt.: EHOMO = ELUMOEg.

c

The DFT calculation data.