Sutton-Chen 10-8 Clusters: Table of Global Minima


Global minima for Sutton-Chen 10-8 clusters with $N\le 80$. For each minimum the energy and point group are given and a structural assignment made if possible. The structural categories are: icosahedral with an anti-Mackay (aM) or a Mackay overlayer (M); decahedral with n atoms along the decahedral axis (dn); close-packed fcc (f), hcp (h), or involving a mixture of stacking sequences and twin planes (c); and clusters involving disclination lines (dis).

Click on a label to access the points file for the structure in Cartesian coordinates. The unit of distance is the latttice constant, a. The first line contains the values of the parameters in the Sutton-Chen potential $\epsilon$, c, a, n and m.

Alternatively, click here to access a tar file containing all the points.

N Energy/$\epsilon$ PG     N Energy/$\epsilon$ PG  
3 -633.7771 D3h     42 -11211.5400 Cs  
4 -904.1153 Td     43 -11490.3063 C2v d4
5 -1163.7670 D3h     44 -11767.0685 Cs  
6 -1433.8252 Oh     45 -12039.6977 C1  
7 -1695.8893 D5h     46 -12318.3028 C3  
8 -1954.1206 D2d     47 -12595.3291 C2v d4
9 -2218.1861 C2v     48 -12875.3949 C1  
10 -2481.7019 C3v     49 -13150.8235 D5h d4
11 -2741.5489 C2v     50 -13433.4182 D3h c
12 -3005.9274 C2     51 -13705.6730 Cs c
13 -3280.3843 Ih M   52 -13986.6288 C2v  
14 -3549.4023 C6v dis   53 -14261.3449 C3v  
15 -3825.6495 C2v     54 -14542.6311 C2v f
16 -4101.6928 Cs     55 -14814.5225 C1 f
17 -4371.8696 Cs     56 -15098.5064 D2h f
18 -4640.1812 Cs     57 -15377.3233 C2v d5
19 -4906.0562 Cs     58 -15647.9269 Cs d5
20 -5171.2334 C2v     59 -15928.8952 C2v d5
21 -5439.9207 C6v dis   60 -16206.2020 C2v d5
22 -5716.6689 Cs     61 -16495.9638 C3v c
23 -5990.7388 C2     62 -16768.1774 Cs c
24 -6266.6622 Cs     63 -17048.9913 Cs c
25 -6533.1606 C1     64 -17336.8555 C2v d5
26 -6803.6959 Cs     65 -17610.0214 C2v d5
27 -7080.7248 Cs     66 -17890.9860 Cs d5
28 -7354.7939 C1     67 -18169.0668 C2v d5
29 -7632.7382 C2     68 -18448.5177 C3v c
30 -7909.1542 C3v     69 -18725.1157 C1 d5
31 -8171.0816 C1     70 -19008.8021 Cs d5
32 -8451.6848 C3     71 -19300.7255 C2v d5
33 -8726.4506 Cs d4   72 -19573.7638 Cs d5
34 -9005.3502 C3     73 -19855.7668 Cs d5
35 -9276.2927 Cs     74 -20138.8921 C5v d5
36 -9551.6256 C2v     75 -20431.3452 D5h d5
37 -9836.6867 C2v     76 -20704.2050 C2v d5
38 -10117.2454 Oh f   77 -20978.9269 C2v d5
39 -10389.6477 C4v f   78 -21252.2801 Cs d5
40 -10661.9303 D4h f   79 -21547.5979 Oh f
41 -10934.9766 Cs     80 -21819.9952 C4v f


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Jon Doye
11/5/1997