{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.561692 -4.6127597 0.4578026 ] [ 0.4050984 1.575614 -1.9965778 ] [ 0.2938378 3.8440781 1.2914914 ] [ 0.3187682 -6.2224408 1.6689095 ] [ -2.5793965 5.4155083 -1.4216257 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.502106411290394e-09 -7.390455748708421e-09 7.33480622661454e-10 ] [ 6.490391856034868e-10 2.524411914205171e-09 -3.198870272768298e-09 ] [ 4.707800534673062e-10 6.158892060349285e-09 2.069197327044261e-09 ] [ 5.107229574944986e-10 -9.969449174072048e-09 2.673887783131017e-09 ] [ -4.132648768073347e-09 8.676600788008352e-09 -2.277695460068434e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.52923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.007403938262599e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4031164 0.082322 2.330771 ] [ -0.020724 1.7703603 0.6168033 ] [ -0.0558471 2.3994446 2.9529599 ] [ 2.7269104 0.4109398 2.2772198 ] [ 2.0248602 2.571308 1.6849201 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.031164e-11 8.2322e-12 2.330771e-10 ] [ -2.0724e-12 1.7703603e-10 6.168033000000001e-11 ] [ -5.58471e-12 2.3994446e-10 2.9529599e-10 ] [ 2.7269104e-10 4.109398e-11 2.2772198e-10 ] [ 2.0248602e-10 2.571308e-10 1.6849201e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.59e-05 8.7e-06 1.44e-05 ] [ -8.2e-06 1.24e-05 7.5e-06 ] [ -2.7e-06 -2.43e-05 -2.09e-05 ] [ 1.53e-05 3.5e-06 -9e-07 ] [ 1.15e-05 -3e-07 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.547460827072e-14 1.393893660096e-14 2.307134333952e-14 ] [ -1.313784829056e-14 1.986699009792e-14 1.2016324656e-14 ] [ -4.32587687616e-15 -3.893289188544e-14 -3.348549137472e-14 ] [ 2.451330229824e-14 5.6076181728e-15 -1.44195895872e-15 ] [ 1.84250311392e-14 -4.8065298624e-16 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -14.226263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.279298597995207e-18 } }