{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.626798 -3.5732855 -3.4096827 ] [ -4.0397291 -5.2867484 2.1918773 ] [ -3.149266 1.7955254 -1.6930158 ] [ -3.031865 1.0600502 5.7991791 ] [ 4.1641199 -3.4557137 -3.486781 ] [ 4.3907645 5.8666926 -3.7687517 ] [ 4.2927737 3.5934795 4.3671748 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.208594343164199e-09 -5.725034487543638e-09 -5.46291390628622e-09 ] [ -6.472359518385425e-09 -8.470304686531806e-09 3.511774565722228e-09 ] [ -5.045680357880332e-09 2.876748817932568e-09 -2.712510333405009e-09 ] [ -4.857583220421791e-09 1.698387647314364e-09 9.291309173851985e-09 ] [ 6.671655549988034e-09 -5.536663698318265e-09 -5.586439000049645e-09 ] [ 7.034780229338602e-09 9.399477725140367e-09 -6.038205863340256e-09 ] [ 6.877781660525113e-09 5.757388842224074e-09 6.996985363506916e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.182055 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.951780371429975e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9866044 2.0283231 1.327647 ] [ 2.3826109 1.2792211 3.7017821 ] [ 1.7617485 4.2768591 2.1254039 ] [ 2.142703 3.5561628 4.4094833 ] [ 4.4778905 2.021193 2.2479939 ] [ 4.1106956 4.6110788 1.7883257 ] [ 4.506672 3.861915 4.16244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9866044e-10 2.0283231e-10 1.327647e-10 ] [ 2.3826109e-10 1.2792211e-10 3.7017821e-10 ] [ 1.7617485e-10 4.2768591e-10 2.1254039e-10 ] [ 2.142703e-10 3.5561628e-10 4.4094833e-10 ] [ 4.4778905e-10 2.021193e-10 2.2479939e-10 ] [ 4.1106956e-10 4.6110788e-10 1.7883257e-10 ] [ 4.506672e-10 3.861915000000001e-10 4.16244e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5e-06 1.72e-05 2.2e-06 ] [ 1.89e-05 -1.28e-05 -1.15e-05 ] [ -1.26e-05 -1.9e-06 -1.27e-05 ] [ -3.3e-06 -6.8e-06 1.29e-05 ] [ -2.62e-05 5.8e-06 3.68e-05 ] [ 9.8e-06 1.31e-05 -4.21e-05 ] [ 1.19e-05 -1.46e-05 1.44e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4032649312e-15 2.755743787776e-14 3.52478856576e-15 ] [ 3.028113813312e-14 -2.050786074624e-14 -1.84250311392e-14 ] [ -2.018742542208e-14 -3.04413557952e-15 -2.034764308416e-14 ] [ -5.28718284864e-15 -1.089480102144e-14 2.066807840832e-14 ] [ -4.197702746496e-14 9.292624400640001e-15 5.896009964544001e-14 ] [ 1.570133088384e-14 2.098851373248e-14 -6.745163573568001e-14 ] [ 1.906590178752e-14 -2.339177866368e-14 2.307134333952e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.765666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846373471814145e-18 } }