| # | Line 100 | Line 100 | Cu SSD_E MAW 2.5525 1.9850 1.1680 1.1250 0.750000 | |
|---|---|---|
| 100 | //Au SSD_E MAW 2.8170 1.7850 1.2680 1.2500 0.2050 0.0 | |
| 101 | //Au SSD_E MAW 2.7510 2.95 1.101 0.750000 0.750000 | |
| 102 | //1. 1.5 2.6500001 -3.000162356E-2 1.30999744 | |
| 103 | < | Au SSD_E MAW 2.65 2.45 1.5 -0.08 0.29 |
| 103 | > | //Au SSD_E MAW 2.7 1.06 1.264 0.16 0.8 |
| 104 | > | Au SSD_E MAW 2.68 0.6 1.33 0.95 -0.25 |
| 105 | ||
| 106 | //LennardJones | |
| 107 | // sigma epsilon | |
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |