{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.820236 0.3137864 -4.8598818 ] [ -1.9927624 -0.1527347 0.260817 ] [ -1.6169935 1.8283642 1.7205205 ] [ 0.7895214 -1.3866609 -0.6643272 ] [ 1.2840317 -2.439419 2.7747126 ] [ 3.7139762 1.9951763 1.0573839 ] [ -0.3575374 -0.1585124 -0.289225 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.916339563538509e-09 5.027412340049971e-10 -7.786388999811422e-09 ] [ -3.192757328089298e-09 -2.447079655249018e-10 4.178748997071937e-10 ] [ -2.590709181685565e-09 2.929362375547696e-09 2.756577720707126e-09 ] [ 1.264952728701285e-09 -2.221675674957487e-09 -1.064369508401526e-09 ] [ 2.057245570106079e-09 -3.908380090135315e-09 4.445579657159183e-09 ] [ 5.950445837847625e-09 3.196624822234248e-09 1.694115763790325e-09 ] [ -5.72838063341618e-10 -2.539648613868979e-10 -4.6338953315088e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.973923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.91843394898594e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6583173 2.9713624 1.3575272 ] [ 1.309344 1.6800423 2.9988568 ] [ 1.7487355 3.9871152 3.4365638 ] [ 4.2910512 1.2729284 2.1517057 ] [ 3.2040919 1.1468147 4.1552971 ] [ 4.7303578 3.5800113 2.5894516 ] [ 3.6267274 3.3661157 4.5764207 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.658317300000001e-10 2.9713624e-10 1.3575272e-10 ] [ 1.309344e-10 1.6800423e-10 2.9988568e-10 ] [ 1.7487355e-10 3.9871152e-10 3.4365638e-10 ] [ 4.2910512e-10 1.2729284e-10 2.1517057e-10 ] [ 3.2040919e-10 1.1468147e-10 4.155297100000001e-10 ] [ 4.730357800000001e-10 3.5800113e-10 2.5894516e-10 ] [ 3.6267274e-10 3.3661157e-10 4.5764207e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.9e-06 2.34e-05 6.2e-05 ] [ 3.2e-05 1.66e-05 -1.62e-05 ] [ -1.5e-05 -3.84e-05 -3.39e-05 ] [ -3.28e-05 2.59e-05 2.49e-05 ] [ 1.4e-06 3.5e-06 -6e-07 ] [ -2.33e-05 -2.84e-05 1.63e-05 ] [ 3.27e-05 -2.5e-06 -5.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.850665441919999e-15 3.749093292672001e-14 9.93349504896e-14 ] [ 5.12696518656e-14 2.659613190528e-14 -2.595526125696e-14 ] [ -2.4032649312e-14 -6.152358223872e-14 -5.431378744512e-14 ] [ -5.255139316223999e-14 4.149637447872e-14 3.989419785791999e-14 ] [ 2.24304726912e-15 5.6076181728e-15 -9.6130597248e-16 ] [ -3.733071526464e-14 -4.550181603071999e-14 2.611547891904e-14 ] [ 5.239117550016001e-14 -4.005441552e-15 -8.4114272592e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }