{ "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" [ [ 0.0140975 0.5833675 2.011711 ] [ 0.3860738 2.863563 1.325373 ] [ 1.128451 1.622429 0.5509609 ] [ 2.086312 0.6042059 2.517228 ] [ 2.318087 2.883056 0.8671461 ] [ 2.902063 1.818717 2.74846 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.40975e-12 5.833675e-11 2.011711e-10 ] [ 3.860738e-11 2.863563e-10 1.325373e-10 ] [ 1.128451e-10 1.622429e-10 5.509609e-11 ] [ 2.086312e-10 6.042059e-11 2.517228e-10 ] [ 2.318087e-10 2.883056e-10 8.671461e-11 ] [ 2.902063e-10 1.818717e-10 2.74846e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -28.9264119 -21.318904 9.4250699 ] [ -12.6751484 4.6434408 -11.3755834 ] [ -10.9700163 18.206999 -17.0251574 ] [ 66.3298464 55.777525 30.9993431 ] [ 16.6196487 17.6687894 -18.0516644 ] [ -30.3779186 -74.9778503 6.0279922 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.634522086981091e-08 -3.41566495698796e-08 1.51006266431858e-08 ] [ -2.030782643165052e-08 7.439612289828848e-09 -1.822569377144058e-08 ] [ -1.757590364565492e-08 2.917082813272898e-08 -2.727730915172011e-08 ] [ 1.06272129163335e-07 8.936544652108752e-08 4.96664227749778e-08 ] [ 2.662761259304911e-08 2.830852129451886e-08 -2.892195466820766e-08 ] [ -4.867079096948547e-08 -1.201277588285023e-07 9.657908173204758e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 327.79581 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.251867831781989e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.2064548 0.4204937 2.0836777 ] [ 0.2895386 2.8982648 1.238047 ] [ 1.0436228 1.7614988 0.4214323 ] [ 2.6312851 1.1382411 2.774109 ] [ 2.4458075 3.018599 0.729504 ] [ 2.6312851 1.1382411 2.774109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.064548e-11 4.204937e-11 2.0836777e-10 ] [ 2.895386e-11 2.8982648e-10 1.238047e-10 ] [ 1.0436228e-10 1.7614988e-10 4.214323e-11 ] [ 2.6312851e-10 1.1382411e-10 2.774109e-10 ] [ 2.4458075e-10 3.018599e-10 7.29504e-11 ] [ 2.6312851e-10 1.1382411e-10 2.774109e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -19.5199869 -17.5571285 7.4814536 ] [ -3.4530827 -9.1722929 -18.951933 ] [ -25.0686714 20.5578492 -3.8272148 ] [ 12.7125878 -2.2609208071022046e+110 -4.521841614204409e+110 ] [ 22.6165655 20.6327886 -12.3538643 ] [ 12.7125878 2.2609208071022046e+110 4.521841614204409e+110 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.127446664950227e-08 -2.812962081108137e-08 1.198661004751999e-08 ] [ -5.53244837162894e-09 -1.469563324350983e-08 -3.036434397156801e-08 ] [ -4.016443923159761e-08 3.293730536217198e-08 -6.131874075339748e-09 ] [ 2.03678109630273e-08 -3.622394458619419e+101 -7.244788917238838e+101 ] [ 3.623573248689186e-08 3.305737151682877e-08 -1.979307255799576e-08 ] [ 2.03678109630273e-08 3.622394458619419e+101 7.244788917238838e+101 ] ] } "relaxed-potential-energy" { "source-value" -4.1835439e+94 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.702776228670454e+75 } }