{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.061869 2.942366 1.677644 ] [ 1.882152 2.580028 5.41738 ] [ 1.143094 3.952812 3.395101 ] [ 3.99886 1.876175 2.533949 ] [ 4.004626 1.895608 4.810911 ] [ 3.218518 3.766044 3.544324 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.061869e-10 2.942366e-10 1.677644e-10 ] [ 1.882152e-10 2.580028e-10 5.41738e-10 ] [ 1.143094e-10 3.952812e-10 3.395101e-10 ] [ 3.99886e-10 1.876175e-10 2.533949e-10 ] [ 4.004626e-10 1.895608e-10 4.810911e-10 ] [ 3.218518e-10 3.766044e-10 3.544324e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5624198 -1.3159554 -2.7334002 ] [ -0.4953069 1.6175285 -1.5857258 ] [ -5.6540552 0.6623186 2.7756677 ] [ 0.7795979 -1.4966046 -2.1278032 ] [ 0.6257517 -0.5007036 1.2866036 ] [ 4.1815926 1.0334165 2.3846578 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.010958546350119e-10 -2.108392975895512e-09 -4.379389895730044e-09 ] [ -7.935691353009235e-10 2.591566346177692e-09 -2.540612803759377e-09 ] [ -9.058795054152669e-09 1.061151376440987e-09 4.447109896049708e-09 ] [ 1.249053529004776e-09 -2.397824900701736e-09 -3.409116540703426e-09 ] [ 1.002564744165855e-09 -8.022156018703948e-10 2.061366208157115e-09 ] [ 6.699649901430287e-09 1.655715755848963e-09 3.820642975768362e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.656212 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.149272331988841e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1862138 3.044304 1.597913 ] [ 1.9563658 2.9258791 5.4607107 ] [ 0.8782989 3.7283039 3.4811106 ] [ 4.0726164 1.8191444 2.413633 ] [ 3.9305626 1.7459538 4.8009734 ] [ 3.2850615 3.7494478 3.6249684 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1862138e-10 3.044304e-10 1.597913e-10 ] [ 1.9563658e-10 2.9258791e-10 5.4607107e-10 ] [ 8.782989e-11 3.7283039e-10 3.4811106e-10 ] [ 4.0726164e-10 1.8191444e-10 2.413633e-10 ] [ 3.9305626e-10 1.7459538e-10 4.800973400000001e-10 ] [ 3.2850615e-10 3.7494478e-10 3.6249684e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 -3e-07 -3e-07 ] [ -4e-07 -2e-07 7e-07 ] [ 9e-07 -3e-07 0.0 ] [ -3e-07 1e-07 -4e-07 ] [ -4e-07 5e-07 -3e-07 ] [ 1e-07 1e-07 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-16 -4.8065298624e-16 -4.8065298624e-16 ] [ -6.408706483200001e-16 -3.2043532416e-16 1.12152363456e-15 ] [ 1.44195895872e-15 -4.8065298624e-16 0.0 ] [ -4.8065298624e-16 1.6021766208e-16 -6.408706483200001e-16 ] [ -6.408706483200001e-16 8.010883104e-16 -4.8065298624e-16 ] [ 1.6021766208e-16 1.6021766208e-16 3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -21.130796 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.385526733009416e-18 } }