Sources | Eq. | SI | Training data | Validation data | ||||||
---|---|---|---|---|---|---|---|---|---|---|
\(R^2\) | \(RMSE\) | \(AIC\) | n | \(R^2\) | \(RMSE\) | \(AIC\) | n | |||
Existing SI model | \(\Delta H\) (Eq. 10) | \(SI\) | 0.743 | 0.097 | −9964 | 5435 | ||||
\(pSI\) | 0.793 | 0.087 | −11,138 | 5435 | ||||||
\(\Delta V\) (Eq. 11) | \(SI\) | 0.428 | 5.022 | 33,002 | 5435 | |||||
\(pSI\) | 0.471 | 4.829 | 32,578 | 5435 | ||||||
New SI model | \(\Delta H\) (Eq. 10) | \(SI\) | 0.742 | 0.097 | −6936 | 3804 | 0.744 | 0.096 | −3006 | 1631 |
\(pSI\) | 0.812 | 0.083 | −8135 | 3804 | 0.855 | 0.072 | −3936 | 1631 | ||
\(\Delta V\) (Eq. 11) | \(SI\) | 0.442 | 4.917 | 22,932 | 3804 | 0.406 | 5.232 | 10,046 | 1631 | |
\(pSI\) | 0.447 | 4.896 | 22,899 | 3804 | 0.433 | 5.112 | 9970 | 1631 |