Table 5 Quantum chemical parameters.
From: Ibuprofen as a corrosion inhibitor for copper in synthetic acid rain solution
Parameter | EHOMO, eV | ELUMO, eV | I, eV | A, eV | χ | η | ΔE, ev | μ, D | ΔN |
|---|---|---|---|---|---|---|---|---|---|
Value | −9.62 | −0.31 | 9.62 | 0.31 | 4.97 | 4.65 | 9.31 | 4.29 | −0.05 |
From: Ibuprofen as a corrosion inhibitor for copper in synthetic acid rain solution
Parameter | EHOMO, eV | ELUMO, eV | I, eV | A, eV | χ | η | ΔE, ev | μ, D | ΔN |
|---|---|---|---|---|---|---|---|---|---|
Value | −9.62 | −0.31 | 9.62 | 0.31 | 4.97 | 4.65 | 9.31 | 4.29 | −0.05 |
