{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.547844 -13.1623537 -14.8216397 ] [ -23.9048114 18.0350028 -12.8051945 ] [ -12.3338555 -14.4453046 13.7067619 ] [ 1.6970147 -0.7619113 -2.2709854 ] [ 26.2326288 -19.4196746 14.8060654 ] [ 9.2016882 14.1220285 -14.473763 ] [ 9.6551793 15.6322129 15.8587554 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.689950905664555e-08 -2.108841537284038e-08 -2.374688460926113e-08 ] [ -3.829972994971332e-08 2.889525984222254e-08 -2.051618325269675e-08 ] [ -1.97610149264255e-08 -2.31439293104547e-08 2.196065346305219e-08 ] [ 2.718917277493926e-09 -1.220716471983335e-09 -3.638519714058136e-09 ] [ 4.202930456548476e-08 -3.111374862766359e-08 2.37219318299158e-08 ] [ 1.474272970593123e-08 2.26259839009713e-08 -2.318952469360007e-08 ] [ 1.546930254409211e-08 2.504556603974817e-08 2.540852713686575e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.6939187 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.072484004267593e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9104484 2.7283698 1.1782174 ] [ 1.5564754 5.1191057 1.0594473 ] [ 2.1974511 2.2044517 3.5230331 ] [ 4.3996616 3.1243495 0.9990601 ] [ 4.4979878 2.9544782 3.5182977 ] [ 3.9189149 5.5876382 1.2926312 ] [ 4.4206297 5.3693859 3.6496775 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9104484e-10 2.7283698e-10 1.1782174e-10 ] [ 1.5564754e-10 5.119105700000001e-10 1.0594473e-10 ] [ 2.1974511e-10 2.2044517e-10 3.5230331e-10 ] [ 4.3996616e-10 3.1243495e-10 9.990601e-11 ] [ 4.4979878e-10 2.9544782e-10 3.5182977e-10 ] [ 3.9189149e-10 5.5876382e-10 1.2926312e-10 ] [ 4.4206297e-10 5.3693859e-10 3.6496775e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 2.1e-06 1.24e-05 ] [ 1.4e-06 -6.5e-06 -1.13e-05 ] [ 8e-06 3.8e-06 8.7e-06 ] [ 4.2e-06 1.59e-05 -1.35e-05 ] [ -1.59e-05 -4.3e-06 -1.3e-06 ] [ 3.5e-06 -2.9e-06 4.3e-06 ] [ -5e-07 -7.9e-06 6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-15 3.36457090368e-15 1.986699009792e-14 ] [ 2.24304726912e-15 -1.04141480352e-14 -1.810459581504e-14 ] [ 1.28174129664e-14 6.08827115904e-15 1.393893660096e-14 ] [ 6.72914180736e-15 2.547460827072e-14 -2.16293843808e-14 ] [ -2.547460827072e-14 -6.889359469440001e-15 -2.08282960704e-15 ] [ 5.6076181728e-15 -4.646312200320001e-15 6.889359469440001e-15 ] [ -8.010883104e-16 -1.265719530432e-14 9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.457688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.797029956682071e-18 } }