SCF iteration reduction on QM9
40Relative Iteration Reduction (1 - RIC)Graph2Mat (Febrer et al. [2025])
Evaluation results
| Method | Links | |
|---|---|---|
| Graph2Mat (Febrer et al. [2025])Theory=PBE/DZP, DFT Software=SIESTA2026.04 | 40 |
| Method | Links | |
|---|---|---|
| Graph2Mat (Febrer et al. [2025])Theory=PBE/DZP, DFT Software=SIESTA2026.04 | 40 |