Research Article
Compatibility of Environmentally Friendly Insulating Gases CF3I and c-C4F8 with Cu Contacts
Table 1
Adsorption energy, charge transfer, and Cu-F bond length.
| Structure | Ead (eV) | Qt (e) | Cu-Fbefore (Å) | Cu-Fafter (Å) |
| c-C4F8 | −0.633 | −0.16 | 2.13 | 2.96 | CF3I-top | −0.835 | −1.04 | 4.85 | 3.31 | CF3I-bridge | −0.993 | −1.12 | 4.76 | 3.11 | CF3I-fcc | −0.746 | −0.26 | 4.71 | 5.25 | CF3I-hcp | −0.691 | −0.31 | 4.76 | 5.12 | CF4 | −0.514 | −0.27 | 2.03 | 3.12 | C2F4 | −1.315 | −0.32 | 2.56 | 2.84 | C2F6 | −0.674 | −0.29 | 2.34 | 3.01 | C3F6 | −1.204 | −0.45 | 2.49 | 2.86 | C3F8 | −0.783 | −0.49 | 2.24 | 2.79 |
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