{ "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" [ [ 0.349925 1.341612 0.6560134 ] [ 0.6162161 0.8811692 2.732129 ] [ 2.287058 0.0970069 0.7690432 ] [ 2.096073 0.9342159 2.106012 ] [ 2.754629 2.399765 1.157711 ] [ 1.653705 1.889806 0.0543731 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.49925e-11 1.341612e-10 6.560134e-11 ] [ 6.162161e-11 8.811692000000001e-11 2.732129e-10 ] [ 2.287058e-10 9.70069e-12 7.690432000000001e-11 ] [ 2.096073e-10 9.342159e-11 2.106012e-10 ] [ 2.754629e-10 2.399765e-10 1.157711e-10 ] [ 1.653705e-10 1.889806e-10 5.43731e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.0641541 -4.7287259 2.4336021 ] [ -14.8082721 -1.1926585 10.2192588 ] [ 4.5675919 -12.1698655 -11.4058317 ] [ 11.5940715 1.6192559 11.9820235 ] [ 12.2518619 10.3619755 5.2199382 ] [ 4.4589009 6.1100184 -18.4489909 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.89419656119953e-08 -7.57625414557062e-09 3.89906042107333e-09 ] [ -2.372546754853411e-08 -1.910849581041489e-09 1.637305766615888e-08 ] [ 7.318089015827664e-09 -1.949827414302273e-08 -1.82741570410765e-08 ] [ 1.857575045022533e-08 2.59433396744664e-09 1.91973180797389e-08 ] [ 1.962964685917484e-08 1.660171502818047e-08 8.363263014964018e-09 ] [ 7.143946835301569e-09 9.789328713790065e-09 -2.955854214085862e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.800283780772393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.293079144122706e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.088092 0.9116468 0.6258265 ] [ 0.2978936 1.0223082 2.8947225 ] [ 2.073381 -0.1213686 0.4749411 ] [ 2.5574482 0.8500566 2.499154 ] [ 3.1083492 2.7818454 1.3782452 ] [ 1.808626 2.0990867 -0.3976076 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.8092e-12 9.116468e-11 6.258265e-11 ] [ 2.978936e-11 1.0223082e-10 2.8947225e-10 ] [ 2.073381e-10 -1.213686e-11 4.749411e-11 ] [ 2.5574482e-10 8.500566000000001e-11 2.499154e-10 ] [ 3.1083492e-10 2.7818454e-10 1.3782452e-10 ] [ 1.808626e-10 2.0990867e-10 -3.976076e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-05 -8.3e-06 1.11e-05 ] [ -5.5e-06 -6.3e-06 -1.3e-05 ] [ 1.5e-05 2.57e-05 1.04e-05 ] [ -5.5e-06 1.09e-05 -1e-05 ] [ 2.85e-05 -1.44e-05 1.26e-05 ] [ -1.34e-05 -7.4e-06 -1.1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.0441356046e-14 -1.32980660622e-14 1.77841606374e-14 ] [ -8.811971486999999e-15 -1.00937127942e-14 -2.082829624199999e-14 ] [ 2.403264951e-14 4.11759394938e-14 1.66626369936e-14 ] [ -8.811971486999999e-15 1.74637253106e-14 -1.602176634e-14 ] [ 4.5662034069e-14 -2.30713435296e-14 2.01874255884e-14 ] [ -2.14691668956e-14 -1.18561070916e-14 -1.7623942974e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.065364719227606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.573955196983444e-18 } }