{ "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" [ [ 1.982478 1.406412 2.920232 ] [ 1.664708 2.759694 5.087468 ] [ 1.282886 3.129979 1.519732 ] [ 2.3658 4.253432 3.372825 ] [ 3.481612 3.001234 2.026348 ] [ 4.008994 2.747584 4.108071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.982478e-10 1.406412e-10 2.920232e-10 ] [ 1.664708e-10 2.759694e-10 5.087468e-10 ] [ 1.282886e-10 3.129979e-10 1.519732e-10 ] [ 2.3658e-10 4.253432e-10 3.372825e-10 ] [ 3.481612e-10 3.001234e-10 2.026348e-10 ] [ 4.008994e-10 2.747584e-10 4.108071e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1899587 -0.9880672 2.2149147 ] [ 0.2536423 -0.8759992 0.3815397 ] [ -3.0298299 0.9677402 -1.9064119 ] [ -3.7656309 4.585248 2.4614189 ] [ 5.3251801 -1.6993395 -8.0205644 ] [ 1.406597 -1.9895823 4.8691029 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.043473905650158e-10 -1.583058180661805e-09 3.548684578643119e-09 ] [ 4.063797664540181e-10 -1.403505449642693e-09 6.112939922833697e-10 ] [ -4.854322670774556e-09 1.550490736222487e-09 -3.054408600959544e-09 ] [ -6.03320584024839e-09 7.346377206695232e-09 3.943627848065982e-09 ] [ 8.531879128061782e-09 -2.722642040133243e-09 -1.285036087317223e-08 ] [ 2.253616846854498e-09 -3.187662272479977e-09 7.801162894921638e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.614576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.501730881701718e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.952174 1.5988158 3.0719197 ] [ 1.7664853 2.6799258 5.295659 ] [ 1.261469 3.1938442 1.3035606 ] [ 2.142154 4.2145599 3.3846205 ] [ 3.6770382 2.9633864 1.7637231 ] [ 3.9871575 2.6478029 4.2151931 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.952174e-10 1.5988158e-10 3.0719197e-10 ] [ 1.7664853e-10 2.6799258e-10 5.295659e-10 ] [ 1.261469e-10 3.1938442e-10 1.3035606e-10 ] [ 2.142154e-10 4.2145599e-10 3.3846205e-10 ] [ 3.6770382e-10 2.9633864e-10 1.7637231e-10 ] [ 3.9871575e-10 2.6478029e-10 4.2151931e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.82e-05 -1.59e-05 2.38e-05 ] [ 0.0 2.7e-06 -1.03e-05 ] [ 3.9e-06 -2.2e-06 -2.25e-05 ] [ 1.05e-05 -5.7e-06 2.31e-05 ] [ 2.9e-06 1.41e-05 -2.2e-06 ] [ 9e-07 7e-06 -1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.915961473879999e-14 -2.54746084806e-14 3.81318038892e-14 ] [ 0.0 4.3258769118e-15 -1.65024193302e-14 ] [ 6.248488872599999e-15 -3.5247885948e-15 -3.6048974265e-14 ] [ 1.6822854657e-14 -9.1324068138e-15 3.70102802454e-14 ] [ 4.6463122386e-15 2.25906905394e-14 -3.5247885948e-15 ] [ 1.4419589706e-15 1.1215236438e-14 -1.9226119608e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.045537 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.891213772938245e-18 } }