{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6273927 -10.4731021 -13.774105 ] [ -5.6830647 -4.653572 4.9585465 ] [ -7.4736174 9.9425101 -1.7437816 ] [ 10.2873647 -5.1019789 -2.4185582 ] [ 11.49671 10.2861429 12.9778983 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.382260699628217e-08 -1.677975947011633e-08 -2.206854918526257e-08 ] [ -9.105273471850219e-09 -7.455844323036647e-09 7.94446734090248e-09 ] [ -1.197405516973583e-08 1.5929657365529e-08 -2.793846134319134e-09 ] [ 1.648217534777642e-08 -8.174271380741022e-09 -3.874957436009098e-09 ] [ 1.841976012987414e-08 1.6480217808365e-08 2.079288541468832e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.28095082 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.501328391071399e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.904228 1.7799074 1.2325373 ] [ 2.2463476 3.0180305 3.2546171 ] [ 1.4520167 5.1237883 2.3016533 ] [ 5.3496742 2.3193866 1.7521357 ] [ 4.5697515 3.5851492 3.8331926 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.904228e-10 1.7799074e-10 1.2325373e-10 ] [ 2.2463476e-10 3.0180305e-10 3.2546171e-10 ] [ 1.4520167e-10 5.1237883e-10 2.3016533e-10 ] [ 5.3496742e-10 2.3193866e-10 1.7521357e-10 ] [ 4.5697515e-10 3.5851492e-10 3.8331926e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.67e-05 -3.7e-06 -5.4e-06 ] [ 3.72e-05 -1.81e-05 1.44e-05 ] [ 6.3e-06 2.9e-06 -3.3e-05 ] [ -5e-07 2.1e-05 -1.67e-05 ] [ -6.3e-06 -2.1e-06 4.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.879988246779999e-14 -5.9280535458e-15 -8.6517538236e-15 ] [ 5.96009707848e-14 -2.899939707539999e-14 2.30713435296e-14 ] [ 1.00937127942e-14 4.6463122386e-15 -5.287182892199999e-14 ] [ -8.010883169999999e-16 3.364570931399999e-14 -2.67563497878e-14 ] [ -1.00937127942e-14 -3.364570931399999e-15 6.520858900379999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.649402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.866439968447287e-18 } }