{ "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" [ [ -6.5399324 0.7899888 3.4766693 ] [ 1.0895039 -1.3475657 0.2588041 ] [ -3.1840311 2.5424648 -3.5888149 ] [ 6.4219687 -3.1084938 -2.6550083 ] [ 1.143542 0.861895 0.1771511 ] [ -1.8360793 -0.3166716 -2.4748246 ] [ 2.9050282 0.5783826 4.8060233 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.047812687921954e-08 1.265701596481699e-09 5.570238316605136e-09 ] [ 1.745577691231872e-09 -2.159038277319854e-09 4.146498818033994e-10 ] [ -5.101380230349317e-09 4.073477695327482e-09 -5.749915376531045e-09 ] [ 1.028912819541935e-08 -4.980356133293869e-09 -4.253792261336061e-09 ] [ 1.832156272397628e-09 1.38090802996143e-09 2.838273531073974e-10 ] [ -2.941723352631076e-09 -5.073638381713944e-10 -3.965106147368395e-09 ] [ 4.654368303151078e-09 9.266710872321682e-10 7.70009823371957e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.086923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.897844541155718e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5766584 2.4206589 3.5746432 ] [ 1.601153 4.5491853 3.1370331 ] [ 2.902865 3.6038965 1.380393 ] [ 4.7589768 2.2860523 2.386088 ] [ 4.6278205 2.6914942 4.8237338 ] [ 5.1347882 4.5303169 1.4136012 ] [ 6.1716571 3.977044 3.5079226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5766584e-10 2.4206589e-10 3.5746432e-10 ] [ 1.601153e-10 4.5491853e-10 3.1370331e-10 ] [ 2.902865e-10 3.6038965e-10 1.380393e-10 ] [ 4.7589768e-10 2.2860523e-10 2.386088e-10 ] [ 4.627820500000001e-10 2.6914942e-10 4.8237338e-10 ] [ 5.1347882e-10 4.5303169e-10 1.4136012e-10 ] [ 6.171657100000001e-10 3.977044e-10 3.5079226e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.28e-05 -1.09e-05 2.68e-05 ] [ -2.33e-05 4.14e-05 -7.14e-05 ] [ -4.98e-05 7.3e-06 5.4e-06 ] [ -5.63e-05 -4.65e-05 -1.3e-05 ] [ 1.96e-05 -2.95e-05 -9.5e-06 ] [ -2.38e-05 1.89e-05 -1.36e-05 ] [ 4.09e-05 1.93e-05 7.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.486819916352e-13 -1.74637253106e-14 4.293833379119999e-14 ] [ -3.733071557219999e-14 6.633011264759999e-14 -1.143954116676e-13 ] [ -7.978839637319999e-14 1.16958894282e-14 8.6517538236e-15 ] [ -9.02025444942e-14 -7.450121348099999e-14 -2.082829624199999e-14 ] [ 3.140266202639999e-14 -4.726421070299999e-14 -1.5220678023e-14 ] [ -3.81318038892e-14 3.02811383826e-14 -2.17896022224e-14 ] [ 6.552902433059999e-14 3.09220090362e-14 1.208041182036e-13 ] ] } "relaxed-potential-energy" { "source-value" -21.977986 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.521261563157912e-18 } }