Table 3. MAEs of Various XC Functionals against Three Benchmark Sets of cIP, VEE and vIP Using 6-31G(d) and cc-pVDZ in Parentheses.
| Functional | cIP | VEE | vIP | Average |
|---|---|---|---|---|
| DTCAM-XI | 0.51 (0.52) | 0.97 (0.87) | 0.30 (0.31) | 0.59 (0.57) |
| DTCAM-XIV | 0.64 (0.55) | 0.67 (0.62) | 0.61 (0.64) | 0.64 (0.60) |
| DTCAM-VAEE | 3.47 (3.54) | 0.57 (0.51) | 1.41 (1.27) | 1.82 (1.77) |