Table 2. Global Reactivity Descriptors.
media | HOMO/eV | LUMO/eV | μ | η | ω | σ |
---|---|---|---|---|---|---|
gas | 7.1913 | 4.8909 | 6.0411 | 1.1502 | 15.8646 | 0.4347 |
solvent | 6.9382 | 1.9531 | 4.4457 | 2.4926 | 3.9647 | 0.2006 |
media | HOMO/eV | LUMO/eV | μ | η | ω | σ |
---|---|---|---|---|---|---|
gas | 7.1913 | 4.8909 | 6.0411 | 1.1502 | 15.8646 | 0.4347 |
solvent | 6.9382 | 1.9531 | 4.4457 | 2.4926 | 3.9647 | 0.2006 |