Murrell-Mottram Na Clusters: Table of Global Minima


Global minima for clusters interacting with the Murrell-Mottram potential up to N=380. 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   N PG Energy   N PG Energy
10 C3v -5.6074   86 C3 -74.0513   162 C1 -147.7420   238 C1 -223.0562   314 C1 -299.7338
11 C2v -6.3651   87 C2v -74.8545   163 Cs -148.5793   239 C1 -223.9348   315 C3v -300.7167
12 C5v -7.2427   88 C1 -75.8190   164 C1 -149.5340   240 C1 -224.9502   316 C3v -301.7250
13 Ih -8.2378   89 C1 -76.8302   165 C1 -150.5304   241 C1 -225.9655   317 C1 -302.6740
14 C3v -8.8671   90 C1 -77.8380   166 C1 -151.5432   242 C1 -226.9807   318 C1 -303.6346
15 C2v -9.6478   91 C1 -78.8475   167 C1 -152.5457   243 C1 -227.9934   319 C1 -304.6498
16 Cs -10.4216   92 C1 -79.8585   168 C1 -153.5457   244 C1 -229.0058   320 C1 -305.6649
17 C2 -11.2000   93 C1 -80.6238   169 C1 -154.4956   245 C1 -230.0222   321 C1 -306.6798
18 C5v -12.0303   94 C1 -81.6204   170 C1 -155.5107   246 C5 -231.1735   322 C1 -307.6946
19 D5h -13.0174   95 C3 -82.6186   171 C1 -156.5257   247 C5 -232.1884   323 Cs -308.7059
20 C2v -13.7841   96 C1 -83.4001   172 C1 -157.5400   248 C5 -233.2033   324 C1 -309.7162
21 C2 -14.5589   97 C1 -84.4050   173 C1 -158.5540   249 C1 -234.2161   325 C1 -310.7253
22 Cs -15.3663   98 C1 -85.4149   174 C1 -159.5683   250 C1 -235.2291   326 C1 -311.6066
23 D3h -16.3342   99 C1 -86.4250   175 C1 -160.5833   251 C1 -236.2427   327 C1 -312.6218
24 D3 -17.1525   100 C1 -87.4337   176 C5 -161.5983   252 C1 -237.2562   328 C1 -313.6267
25 C3 -18.0055   101 D3 -88.4433   177 C5 -162.6123   253 C1 -238.2701   329 C1 -314.6424
26 Td -18.8419   102 C1 -89.2340   178 C5 -163.6260   254 C1 -239.2809   330 C1 -315.6574
27 C1 -19.6607   103 C2 -90.2411   179 C1 -164.4778   255 C1 -240.2923   331 C1 -316.6724
28 T -20.6634   104 C1 -91.2126   180 C1 -165.4905   256 C1 -241.3035   332 C1 -317.6870
29 C3 -21.4457   105 C1 -92.0246   181 C1 -166.5017   257 C1 -242.3150   333 C1 -318.7014
30 Cs -22.2426   106 C1 -92.9983   182 C1 -167.5129   258 C1 -243.3271   334 C1 -319.7124
31 C2 -23.1592   107 C1 -94.0072   183 C1 -168.5239   259 C1 -244.0646   335 C1 -320.7228
32 D3 -24.1273   108 C1 -94.9614   184 D3d -169.5349   260 C1 -244.9693   336 C1 -321.5709
33 C2 -24.9408   109 C1 -95.9676   185 C1 -170.2937   261 C1 -245.9393   337 C1 -322.5865
34 T -25.8508   110 C2 -96.9738   186 C1 -171.3060   262 C1 -246.9498   338 C1 -323.6023
35 D3 -26.7352   111 C1 -97.9239   187 C1 -172.3175   263 C1 -247.9618   339 C1 -324.6175
36 C2 -27.6260   112 C1 -98.9292   188 C1 -173.3278   264 C1 -248.9148   340 C1 -325.6422
37 C2 -28.4760   113 C1 -99.9359   189 C1 -174.3382   265 C1 -249.9317   341 C1 -326.6508
38 C1 -29.3991   114 C2 -100.9443   190 C1 -175.3490   266 C1 -250.9465   342 C1 -327.6648
39 C5 -30.3957   115 Cs -101.9581   191 C1 -176.1771   267 C1 -251.9608   343 C1 -328.6727
40 C1 -31.1968   116 D5h -102.9720   192 C1 -177.1917   268 C1 -252.9737   344 C1 -329.7064
41 C1 -32.0456   117 Cs -103.7341   193 C1 -178.2065   269 C1 -253.9848   345 C1 -330.7683
42 D2 -33.0462   118 C1 -104.6432   194 C1 -179.2217   270 C1 -254.9955   346 C1 -331.8140
43 C1 -33.8536   119 C1 -105.6494   195 C1 -180.2353   271 C1 -256.0036   347 C1 -332.9797
44 Cs -34.7272   120 C1 -106.6011   196 C1 -181.2489   272 C1 -257.0397   348 C5 -333.9998
45 D3 -35.7071   121 C1 -107.6090   197 C1 -182.2625   273 C1 -258.0615   349 C1 -335.0156
46 C2 -36.6464   122 C1 -108.6178   198 C1 -183.2759   274 C1 -259.0847   350 C1 -336.0307
47 C1 -37.4999   123 C1 -109.4185   199 C1 -184.2891   275 C1 -260.0997   351 C1 -337.0462
48 C1 -38.4412   124 C1 -110.4344   200 C1 -185.3024   276 C1 -261.1147   352 C1 -338.0623
49 C3v -39.4337   125 C1 -111.4373   201 C1 -186.1824   277 C1 -262.1296   353 C1 -339.0782
50 C1 -40.2749   126 C1 -112.3255   202 C1 -187.1941   278 C1 -263.1327   354 C1 -340.0935
51 C2v -41.2874   127 C2 -113.3551   203 C1 -188.2059   279 C1 -264.1534   355 C1 -341.1092
52 C3v -42.2995   128 C1 -114.3598   204 C1 -189.2107   280 C1 -265.1598   356 C1 -342.1242
53 C2v -43.3111   129 C2 -115.3646   205 C1 -190.2158   281 C1 -266.1623   357 D3d -343.2003
54 C5v -44.3226   130 C1 -116.3671   206 C1 -191.2211   282 C1 -267.1657   358 C1 -344.2141
55 Ih -45.3340   131 C2 -117.3698   207 C1 -192.1761   283 C1 -268.1978   359 C1 -345.2281
56 Cs -46.0370   132 C1 -118.2338   208 C1 -193.1896   284 C3v -269.2552   360 C1 -346.2417
57 C2v -46.8569   133 C1 -119.2612   209 C1 -194.2029   285 C3v -270.2973   361 C1 -347.2531
58 C3v -47.7698   134 Ih -120.3335   210 C1 -195.2163   286 Cs -271.3126   362 C1 -348.2670
59 C3v -48.7277   135 Ih -121.4021   211 C1 -196.2295   287 Cs -272.3279   363 C1 -349.2806
60 D3 -49.5772   136 C5v -122.4167   212 C1 -197.2426   288 Cs -273.3431   364 C1 -350.2941
61 C2v -50.5042   137 C2v -123.4313   213 C1 -198.2557   289 Cs -274.3583   365 C1 -351.3049
62 C1 -51.4584   138 C3v -124.4459   214 C1 -199.2681   290 C5v -275.4555   366 C1 -352.3156
63 C2v -52.3115   139 C1 -125.4605   215 C1 -200.2811   291 C5v -276.5585   367 C1 -353.3261
64 D3 -53.2475   140 C1 -126.4750   216 C1 -201.2946   292 C5v -277.5877   368 C1 -354.3367
65 C1 -54.1928   141 C5v -127.4895   217 C1 -202.0898   293 C1 -278.6264   369 C1 -355.3467
66 C1 -55.0278   142 C1 -128.5040   218 C1 -203.1019   294 C1 -279.7091   370 C1 -356.2072
67 C1 -56.0159   143 C2v -129.5184   219 C1 -204.1133   295 C1 -280.7920   371 C1 -357.2202
68 C1 -56.9481   144 C3 -130.5328   220 C1 -205.1196   296 Ih -281.9772   372 C1 -358.2305
69 C1 -57.9609   145 C2v -131.5472   221 C1 -206.1258   297 Ih -283.0030   373 C1 -359.2433
70 C5 -58.9705   146 C5v -132.5615   222 C1 -207.1324   298 C5v -284.0183   374 C1 -360.2560
71 C5 -59.9789   147 Ih -133.5758   223 C1 -208.1091   299 C1 -285.0336   375 C1 -361.2704
72 C2 -60.8163   148 Cs -134.2823   224 C1 -209.1224   300 C3v -286.0489   376 C1 -362.2839
73 C1 -61.7412   149 C1 -135.1735   225 C1 -210.1356   301 C1 -287.0642   377 C1 -363.2985
74 D3d -62.7494   150 C3v -136.1398   226 C1 -211.1488   302 C1 -288.0795   378 C1 -364.3114
75 C2 -63.5583   151 C1 -137.0336   227 C1 -212.1621   303 C2 -289.0948   379 C1 -365.3255
76 C1 -64.4937   152 C1 -137.9820   228 C1 -213.1754   304 C1 -290.1101   380 C1 -366.3360
77 C2 -65.5011   153 C1 -138.9290   229 C1 -214.1880   305 C1 -291.1254
78 C1 -66.3403   154 C1 -139.9184   230 C1 -215.2003   306 C3v -292.1407
79 C1 -67.2995   155 Cs -140.9276   231 C1 -216.2120   307 C1 -293.1560
80 D3 -68.3044   156 C1 -141.9340   232 C1 -217.2237   308 C1 -294.1712
81 C1 -69.2047   157 C1 -142.8167   233 C1 -218.0097   309 Ih -295.1865
82 C1 -70.2127   158 C1 -143.7702   234 C1 -219.0215   310 Cs -295.8981
83 C1 -71.2208   159 C2v -144.7222   235 C1 -220.0324   311 Cs -296.7961
84 C1 -72.0590   160 C1 -145.7300   236 C2 -221.0434   312 C3v -297.7647
85 C1 -73.0545   161 C1 -146.7359   237 C1 -222.0498   313 C1 -298.7500

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Jon Doye
07/6/2005