Global minima for (NaCl)NCl- clusters with N<36. For each minimum the energy and point group are given.
Click on an energy to access the points file for the structure in Cartesian coordinates. The unit of distance is the bohr.
Alternatively, click here to access a tar file containing all the points.
| C+BM | Welch | |||
| N | Energy/eV | PG | Energy/eV | PG |
| 1 | -7.712 | Dinftyh | -7.960 | Dinftyh |
| 2 | -14.948 | Dinftyh | -15.272 | C2v |
| 3 | -22.452 | C3v | -23.040 | C3v |
| 4 | -30.204 | C4v | -30.871 | C4v |
| 5 | -37.386 | C2v | -38.221 | C1 |
| 6 | -44.891 | Cs | -45.793 | Cs |
| 7 | -52.511 | C2v | -53.456 | C2v |
| 8 | -60.208 | C4v | -61.163 | C4v |
| 9 | -67.647 | C3h | -68.979 | C3h |
| 10 | -75.141 | Cs | -76.398 | C2 |
| 11 | -82.658 | Cs | -84.007 | C1 |
| 12 | -90.482 | C4v | -91.668 | C4v |
| 13 | -98.672 | Oh | -99.756 | Oh |
| 14 | -105.567 | Cs | -106.880 | Cs |
| 15 | -113.132 | C1 | -114.570 | Cs |
| 16 | -121.086 | C2v | -122.497 | C2v |
| 17 | -128.703 | C4v | -129.994 | C4v |
| 18 | -135.761 | C1 | -137.381 | C1 |
| 19 | -143.611 | Cs | -145.255 | C2 |
| 20 | -151.084 | Cs | -152.667 | Cs |
| 21 | -158.972 | C4v | -160.448 | C4v |
| 22 | -167.158 | D4h | -168.576 | D4h |
| 23 | -174.123 | Cs | -175.757 | C1 |
| 24 | -181.602 | C1 | -183.331 | D3 |
| 25 | -189.525 | Cs | -191.227 | Cs |
| 26 | -197.173 | C4v | -198.766 | C4v |
| 27 | -204.809 | C2v | -206.602 | C2v |
| 28 | -212.385 | Cs | -214.152 | Cs |
| 29 | -219.969 | Cs | -221.732 | C1 |
| 30 | -227.494 | Cs | -229.315 | Cs |
| 31 | -235.584 | D4h | -237.305 | D4h |
| 32 | -242.755 | Cs | -244.505 | Cs |
| 33 | -250.295 | C1 | -252.320 | C1 |
| 34 | -258.304 | Cs | -260.187 | Cs |
| 35 | -265.748 | Cs | -267.756 | Cs |
![[Back]](http://www-wales.ch.cam.ac.uk/images/back.gif)
Return to The Cambridge Cluster Database.