{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0559119 -0.7302801 -1.5284621 ] [ 2.3857264 -5.679907 1.4601085 ] [ -9.9911811 2.2969972 -2.985547 ] [ -2.2180924 0.8401542 -3.9070548 ] [ 0.9567281 0.722726 4.4097051 ] [ 5.0424107 -2.673271 -5.1801229 ] [ 3.7684964 5.2235806 7.7313732 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.95807397425446e-11 -1.170037712495183e-09 -2.448866262574571e-09 ] [ 3.822355093196937e-09 -9.100214278693038e-09 2.339351721804789e-09 ] [ -1.600763690448242e-08 3.680195242203424e-09 -4.783373643108798e-09 ] [ -3.553775815332982e-09 1.346075428196963e-09 -6.259791908317543e-09 ] [ 1.532847406911215e-09 1.157934709984284e-09 7.065126474050633e-09 ] [ 8.078832602571582e-09 -4.283052332549814e-09 -8.299471871628317e-09 ] [ 6.037796877393117e-09 8.3690987831357e-09 1.238702548977381e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.83475806491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.056354947465209e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.833182 2.2488807 1.2409701 ] [ 3.0080456 2.5774297 3.7327853 ] [ 1.6941044 4.5068735 2.6616599 ] [ 5.2204366 2.4433467 1.3783662 ] [ 5.3687258 3.0162159 3.654171 ] [ 3.9221181 4.5976811 1.5114625 ] [ 3.7294726 5.1246923 3.999285 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.833182e-10 2.2488807e-10 1.2409701e-10 ] [ 3.0080456e-10 2.5774297e-10 3.7327853e-10 ] [ 1.6941044e-10 4.506873500000001e-10 2.6616599e-10 ] [ 5.220436600000001e-10 2.4433467e-10 1.3783662e-10 ] [ 5.3687258e-10 3.0162159e-10 3.654171e-10 ] [ 3.9221181e-10 4.5976811e-10 1.5114625e-10 ] [ 3.7294726e-10 5.124692300000001e-10 3.999285e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.03e-05 9.19e-05 2.16e-05 ] [ 3.3e-06 3.95e-05 -4.41e-05 ] [ 6.3e-06 -3.6e-05 -6.5e-06 ] [ -2.6e-06 -2.82e-05 1.1e-06 ] [ -1.91e-05 1.06e-05 -1.2e-05 ] [ -6.33e-05 -7.3e-05 7.71e-05 ] [ 2.51e-05 -4.8e-06 -3.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.05894846902e-14 1.472400326646e-13 3.46070152944e-14 ] [ 5.2871828922e-15 6.328597704299999e-14 -7.06559895594e-14 ] [ 1.00937127942e-14 -5.7678358824e-14 -1.0414148121e-14 ] [ -4.165659248399999e-15 -4.51813810788e-14 1.7623942974e-15 ] [ -3.06015737094e-14 1.69830723204e-14 -1.9226119608e-14 ] [ -1.014177809322e-13 -1.16958894282e-13 1.235278184814e-13 ] [ 4.02146335134e-14 -7.690447843199998e-15 -5.94407531214e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.047526064916394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.891532456271501e-18 } }