{ "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" [ [ 2.510917 2.898515 1.87318 ] [ 1.068289 2.930408 3.679489 ] [ 1.738918 4.773151 2.611531 ] [ 3.136153 2.016935 3.60422 ] [ 3.930075 4.659698 3.066974 ] [ 4.662989 3.229538 1.53666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.510917e-10 2.898515000000001e-10 1.87318e-10 ] [ 1.068289e-10 2.930408e-10 3.679489e-10 ] [ 1.738918e-10 4.773151000000001e-10 2.611531e-10 ] [ 3.136153000000001e-10 2.016935e-10 3.604220000000001e-10 ] [ 3.930075e-10 4.659698e-10 3.066974e-10 ] [ 4.662989e-10 3.229538e-10 1.53666e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7389451 -0.9914043 -5.9393231 ] [ -2.2325398 -0.6787998 1.7549498 ] [ -1.7644543 3.6956093 -0.1412081 ] [ 2.7603468 -2.3875756 3.7634735 ] [ 1.0462768 1.0150077 1.4973319 ] [ 1.9293156 -0.6528373 -0.935224 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.786097184074719e-09 -1.58840479122059e-09 -9.515844614197381e-09 ] [ -3.576923072565508e-09 -1.087557169763716e-09 2.811739540237636e-09 ] [ -2.826967427930029e-09 5.921018820071054e-09 -2.262403164875885e-10 ] [ 4.422563108260094e-09 -3.825317806712533e-09 6.029749254700348e-09 ] [ 1.676320227845437e-09 1.62622160687198e-09 2.398990163758044e-09 ] [ 3.091104348464725e-09 -1.045960659246196e-09 -1.498394028011059e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.087839 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.897991276659445e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0318041 3.0449934 1.1451427 ] [ 1.3523253 2.6328331 3.4131971 ] [ 1.7654921 4.8814042 2.6723408 ] [ 3.6016841 2.4294358 4.0501028 ] [ 4.0148645 4.6779947 3.3092293 ] [ 4.281171 2.8415839 1.7820413 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0318041e-10 3.0449934e-10 1.1451427e-10 ] [ 1.3523253e-10 2.6328331e-10 3.4131971e-10 ] [ 1.7654921e-10 4.8814042e-10 2.6723408e-10 ] [ 3.6016841e-10 2.4294358e-10 4.0501028e-10 ] [ 4.0148645e-10 4.6779947e-10 3.3092293e-10 ] [ 4.281171e-10 2.8415839e-10 1.7820413e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.99e-05 4.6e-06 -1.83e-05 ] [ -2.1e-05 -4.3e-06 1.44e-05 ] [ 1.39e-05 5.04e-05 1.3e-06 ] [ 4.69e-05 -6.29e-05 3.96e-05 ] [ -6.22e-05 4.88e-05 -7e-06 ] [ -7.6e-06 -3.66e-05 -3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.790508096192e-14 7.370012455680001e-15 -2.931983216064e-14 ] [ -3.36457090368e-14 -6.889359469440001e-15 2.307134333952e-14 ] [ 2.227025502912e-14 8.074970168832e-14 2.08282960704e-15 ] [ 7.514208351552e-14 -1.0077690944832e-13 6.344619418368e-14 ] [ -9.965538581376e-14 7.818621909504e-14 -1.12152363456e-14 ] [ -1.217654231808e-14 -5.863966432128e-14 -4.8065298624e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.411418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.27026967169763e-18 } }