Table 1.
Coefficient | a | b | c | r2 | RMSrD |
---|---|---|---|---|---|
Full PBE | −7.7915 | −1.9369 | 1.4284 | 0.9966 | 0.0011 |
Charge view (map) | −7.7935 | 0.8683 | 3.5828 | 0.9768 | 0.00062 |
Charge view (nomap) | −7.7838 | −1.6670 | 1.3078 | 0.9976 | 0.00087 |
Coefficient | a | b | c | r2 | RMSrD |
---|---|---|---|---|---|
Full PBE | −7.7915 | −1.9369 | 1.4284 | 0.9966 | 0.0011 |
Charge view (map) | −7.7935 | 0.8683 | 3.5828 | 0.9768 | 0.00062 |
Charge view (nomap) | −7.7838 | −1.6670 | 1.3078 | 0.9976 | 0.00087 |