{ "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" [ [ 2.457406 2.100076 2.252169 ] [ 2.703043 4.198802 1.427674 ] [ 1.54274 3.831579 3.120531 ] [ 4.586348 2.503005 1.027399 ] [ 4.020521 2.853252 3.469677 ] [ 5.359849 4.671518 1.954564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.457406e-10 2.100076e-10 2.252169e-10 ] [ 2.703043e-10 4.198802e-10 1.427674e-10 ] [ 1.54274e-10 3.831579e-10 3.120531e-10 ] [ 4.586348e-10 2.503005e-10 1.027399e-10 ] [ 4.020521e-10 2.853252e-10 3.469677e-10 ] [ 5.359849e-10 4.671518e-10 1.954564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.800517 -7.123949 -3.280689 ] [ 3.1571731 3.5378134 -5.4076277 ] [ -4.841032 2.5582127 5.762688 ] [ 0.3108074 0.8003348 0.5923806 ] [ 4.0497865 1.2897992 2.5610681 ] [ -0.8762181 -1.0622111 -0.22782 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.884746242752953e-09 -1.141382453557154e-08 -5.256243215915732e-09 ] [ 5.05834892863866e-09 5.66820191823296e-09 -8.663974674930476e-09 ] [ -7.756188290944666e-09 4.098708578973644e-09 9.23284398656471e-09 ] [ 4.97968349851634e-10 1.282277705372644e-09 9.490983479354766e-10 ] [ 6.488473249531459e-09 2.066486123766543e-09 4.103283434096677e-09 ] [ -1.403856154541796e-09 -1.701849790774251e-09 -3.65007877750656e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.187855 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.112927295950039e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8786099 1.6461304 2.4317558 ] [ 2.9516215 4.7524104 1.1485496 ] [ 1.8313158 3.7465776 2.9525057 ] [ 3.9989148 2.6519631 0.6277993 ] [ 3.9445706 3.1776583 3.9476791 ] [ 5.0648743 4.1834922 2.1437246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8786099e-10 1.6461304e-10 2.4317558e-10 ] [ 2.9516215e-10 4.7524104e-10 1.1485496e-10 ] [ 1.8313158e-10 3.7465776e-10 2.9525057e-10 ] [ 3.9989148e-10 2.6519631e-10 6.277993e-11 ] [ 3.9445706e-10 3.1776583e-10 3.9476791e-10 ] [ 5.0648743e-10 4.1834922e-10 2.1437246e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 5.8e-06 -1.15e-05 ] [ -3.7e-06 -9.4e-06 6.3e-06 ] [ 1.81e-05 -4.9e-06 -6.4e-06 ] [ -6.4e-06 3.2e-06 9.7e-06 ] [ -8.1e-06 5.4e-06 8.6e-06 ] [ 2.4e-06 1e-07 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 9.292624400640001e-15 -1.84250311392e-14 ] [ -5.928053496960001e-15 -1.506046023552e-14 1.009371271104e-14 ] [ 2.899939683648e-14 -7.850665441919999e-15 -1.025393037312e-14 ] [ -1.025393037312e-14 5.126965186560001e-15 1.554111322176e-14 ] [ -1.297763062848e-14 8.65175375232e-15 1.377871893888e-14 ] [ 3.84522388992e-15 1.6021766208e-16 -1.073458335936e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.817009 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.014817189318319e-18 } }