Zinc Clusters: Table of Global Minima

Global minima for clusters interacting with zinc Gupta potential up to N=125. For each minimum the energy and point group are given.

Click on a label to access the points file for the structure in Cartesian coordinates.

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

N PG Energy   N PG Energy   N PG Energy
3 D3h -3.751296   34 C3 -45.125218   65 C1 -86.749702   96 C2v -128.501419
4 Td -5.099346   35 Cs -46.472931   66 C1 -88.097872   97 Cs -129.836679
5 D3h -6.422287   36 D2h -47.814946   67 C1 -89.426800   98 C2v -131.170669
6 Oh -7.765873   37 C1 -49.144718   68 C1 -90.782264   99 Cs -132.525475
7 D5h -9.088519   38 Cs -50.499983   69 C1 -92.135925   100 C2v -133.883827
8 D2d -10.409083   39 C2v -51.846864   70 C1 -93.473840   101 Cs -135.219057
9 C2v -11.733002   40 Cs -53.182148   71 Cs -94.828826   102 C1 -136.566429
10 C3v -13.055156   41 Cs -54.521834   72 Cs -96.168254   103 C1 -137.902829
11 C2 -14.379679   42 D4 -55.874358   73 Cs -97.513085   104 C1 -139.255744
12 C2 -15.706971   43 C4 -57.213737   74 Cs -98.853247   105 C1 -140.593303
13 Cs -17.032142   44 Cs -58.554345   75 C2v -100.203580   106 C1 -141.928489
14 C6v -18.369312   45 C2v -59.895318   76 C1 -101.545341   107 C1 -143.279843
15 Cs -19.697479   46 Cs -61.227348   77 Cs -102.900278   108 C1 -144.635048
16 Cs -21.042019   47 Cs -62.580198   78 C1 -104.238674   109 C1 -145.978993
17 C2v -22.395676   48 Cs -63.916581   79 C2v -105.595357   110 C1 -147.337545
18 C4v -23.735972   49 C2v -65.269233   80 C2v -106.927940   111 C2 -148.697585
19 D4d -25.067563   50 Cs -66.601903   81 Cs -108.284296   112 C1 -150.033337
20 C2v -26.395373   51 C1 -67.938575   82 Cs -109.625208   113 C1 -151.385243
21 Cs -27.715028   52 C2v -69.281361   83 Cs -110.976689   114 C1 -152.720206
22 C2v -29.042499   53 C1 -70.622509   84 Cs -112.322650   115 C2 -154.071651
23 C1 -30.386460   54 C1 -71.969642   85 C1 -113.668080   116 C1 -155.420956
24 C2 -31.728122   55 C1 -73.310032   86 C2v -115.021815   117 C1 -156.762711
25 C2 -33.075590   56 C1 -74.649595   87 C2v -116.375101   118 C1 -158.109816
26 C2 -34.412179   57 C1 -75.992628   88 C2v -117.726908   119 C1 -159.451202
27 C2 -35.744950   58 C1 -77.336947   89 Cs -119.057698   120 C2v -160.812498
28 D6d -37.076416   59 C1 -78.672227   90 Cs -120.405576   121 C1 -162.152965
29 C2 -38.410947   60 C1 -80.019432   91 C2v -121.767147   122 C1 -163.502185
30 C1 -39.768212   61 C2 -81.363067   92 C2v -123.118340   123 C2v -164.859277
31 C1 -41.107234   62 C1 -82.708058   93 Cs -124.451825   124 C1 -166.196591
32 C1 -42.444864   63 C1 -84.061400   94 Cs -125.796431   125 C1 -167.548063
33 C1 -43.776617   64 C2 -85.419385   95 Cs -127.142167


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Jonathan Doye
26/3/2003