Table 4.
CPU time (in hours) in free energy calculation of 2nvh and 2nvh-w
2nvh |
2nvh-w |
|||||
---|---|---|---|---|---|---|
Poisson | PB | Total | Poisson | PB | Total | |
Super-Gaussian | ||||||
ϵgap = 2 | 1.70 | 0.38 | 2.08 | 1.67 | 0.22 | 1.89 |
ϵgap = 3 | 1.66 | 0.22 | 1.88 | 1.71 | 0.22 | 1.93 |
ϵgap = 4 | 1.72 | 0.23 | 1.95 | 1.74 | 0.23 | 1.97 |
ϵgap = 5 | 1.79 | 0.22 | 2.01 | 1.68 | 0.24 | 1.92 |
ϵgap = 6 | 1.79 | 0.23 | 2.02 | 1.67 | 0.24 | 1.91 |
ϵgap = 7 | 1.72 | 0.22 | 1.94 | 1.68 | 0.23 | 1.91 |
ϵgap = 8 | 1.93 | 0.24 | 2.17 | 1.71 | 0.23 | 1.94 |
2-dielectric | 0.05 | 1.70 | 1.75 | 0.03 | 1.85 | 1.88 |