From: Miguel <mig...@us...> - 2005-01-08 11:48:24
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Update of /cvsroot/jmol/Jmol/samples/xyz In directory sc8-pr-cvs1.sourceforge.net:/tmp/cvs-serv26378/samples/xyz Added Files: relax.xyz Log Message: large xyz file --- NEW FILE: relax.xyz --- 49651 DislocEam simulation (crashes at 33397 atoms) Al 2.3209 83.2618 4.69 Al 3.7095 83.2981 2.28 Al 2.0326 77.1487 4.42 Al 2.1274 79.0738 7.73 Al 2.2221 80.9976 11.02 Al 2.3168 82.9201 14.3 Al 3.4325 77.1844 2 Al 2.1294 79.2427 2.9 Al 3.6165 81.2035 3.79 Al 3.5236 79.1097 5.31 Al 4.9196 79.1456 2.9 Al 2.2241 81.1674 6.2 Al 3.7075 83.1272 7.09 Al 3.6146 81.0337 8.61 Al 5.007 81.0698 6.2 Al 2.3189 83.0909 9.49 Al 3.7056 82.9564 11.89 [...49614 lines suppressed...] C 109.64 90.2805 61.58 C 107.86 90.2805 63.36 C 109.64 90.2805 65.14 C 107.86 90.2805 66.92 C 110.53 91.1705 67.81 C 109.64 90.2805 68.7 C 108.75 91.1705 69.59 C 107.86 90.2805 70.48 C 110.53 91.1705 71.37 C 111.42 90.2805 9.96 C 111.42 90.2805 13.52 C 111.42 90.2805 20.64 C 111.42 90.2805 24.2 C 111.42 90.2805 27.76 C 111.42 90.2805 38.44 C 111.42 90.2805 42 C 111.42 90.2805 49.12 C 111.42 90.2805 52.68 C 111.42 90.2805 56.24 C 111.42 90.2805 63.36 |