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. 2015 Oct 22;7(1):781–787. doi: 10.1039/c5sc03097h

Table 2. Values of VT for all SAMs for positive (V+T) and negative bias (V–T) as well as gas-phase calculated HOMO energies. Errors are 95% CI.

SAM V + T (V) V – T (V) HOMO a (eV) μ net a (D)
TP1 0.52 ± 0.05 –0.65 ± 0.05 –5.65 +0.01
TP1-up 0.80 ± 0.06 –0.85 ± 0.03 –6.08 –2.75
TP1-down 0.40 ± 0.02 –0.43 ± 0.04 –6.08 +2.34

aGas-phase HSE06/6-311+g(2d,2p) DFT calculations.