{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3586582 -2.2577259 7.0006148 ] [ 3.3562234 -3.1985184 -3.0939028 ] [ -4.8114347 4.7776423 -0.1531789 ] [ 4.0857543 -0.8004976 0.380962 ] [ -5.2054286 1.6043159 -3.8202091 ] [ 0.0135955 0.2758927 -0.5427908 ] [ 0.2026319 -0.4011088 0.2285048 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.778987024498211e-09 -3.617275653154639e-09 1.121622136378647e-08 ] [ 5.377262665661887e-09 -5.124591401678623e-09 -4.956978733187658e-09 ] [ -7.708768188845862e-09 7.65462679560514e-09 -2.454196523798611e-10 ] [ 6.546100017793069e-09 -1.28253853972651e-09 6.103684098132097e-10 ] [ -8.340016004163676e-09 2.570397427357711e-09 -6.120649706587409e-09 ] [ 2.17823922480864e-11 4.420288337893882e-10 -8.696467297453287e-10 ] [ 3.246520928082835e-10 -6.42647141757143e-10 3.661050483005798e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.5967847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.217139083959114e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.733428 2.1951812 4.6893568 ] [ 0.4695225 3.8741713 2.0640596 ] [ 2.4282959 3.0899696 2.6960804 ] [ 4.2619211 3.310898 1.4846509 ] [ 3.92801 1.4887006 6.3978906 ] [ 7.7488566 5.7976831 1.6821985 ] [ 6.2038849 4.3020443 1.2091783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.733428e-10 2.1951812e-10 4.6893568e-10 ] [ 4.695225e-11 3.8741713e-10 2.0640596e-10 ] [ 2.4282959e-10 3.0899696e-10 2.6960804e-10 ] [ 4.2619211e-10 3.310898e-10 1.4846509e-10 ] [ 3.92801e-10 1.4887006e-10 6.397890600000001e-10 ] [ 7.7488566e-10 5.797683100000001e-10 1.6821985e-10 ] [ 6.203884900000001e-10 4.302044300000001e-10 1.2091783e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.068441 -0.0792162 0.1404502 ] [ -0.2275702 0.0633629 -0.1022672 ] [ 0.4769527 -0.052888 -0.0718252 ] [ -0.4445663 -0.051909 0.1682795 ] [ -0.096767 0.0243796 -0.0668066 ] [ -0.1120653 -0.1529098 -0.0777956 ] [ 0.3355752 0.2491805 0.0099649 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.096545701041728e-10 -1.26918343628617e-10 2.250260268266842e-10 ] [ -3.646076540307802e-10 1.015185570060883e-10 -1.638501169146778e-10 ] [ 7.641624651674362e-10 -8.47359171208704e-11 -1.150766562242842e-10 ] [ -7.12273732255559e-10 -8.31673862091072e-11 2.696134806599136e-10 ] [ -1.550378250649536e-10 3.906042514445568e-11 -1.070359726351373e-10 ] [ -1.795484036629383e-10 -2.449885066512038e-10 -1.246422915211085e-10 ] [ 5.376507399602843e-10 3.992311714592544e-10 1.596552980860992e-11 ] ] } "relaxed-potential-energy" { "source-value" -15.742744 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.522265638403948e-18 } }