{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5280989 -4.2460278 -8.6074198 ] [ -20.2716315 -0.7193368 9.3152049 ] [ 9.5147443 -15.4437591 4.5525824 ] [ 6.9310669 7.0011684 -21.1917408 ] [ 8.3539192 13.4079553 15.9313733 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.254814194250197e-09 -6.802886472426859e-09 -1.379060676897101e-08 ] [ -3.247873405477284e-08 -1.152504603441085e-09 1.49246035087416e-08 ] [ 1.524430087035006e-08 -2.474362976728725e-08 7.294041085545555e-09 ] [ 1.110479334438073e-08 1.121710832876374e-08 -3.395291166381349e-08 ] [ 1.338445403429224e-08 2.148191251439145e-08 2.552487383849734e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.98427245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.576978307887537e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.103372 0.8490549 0.6536589 ] [ -0.3182836 1.4174222 3.0164329 ] [ 1.9817917 0.2791909 2.4133787 ] [ 2.1285656 2.2567751 0.6764131 ] [ 1.7068159 2.8252773 3.0391589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.03372e-11 8.490549e-11 6.536589000000001e-11 ] [ -3.182836e-11 1.4174222e-10 3.0164329e-10 ] [ 1.9817917e-10 2.791909e-11 2.4133787e-10 ] [ 2.1285656e-10 2.2567751e-10 6.764131e-11 ] [ 1.7068159e-10 2.8252773e-10 3.0391589e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.01e-05 -3.49e-05 -5.67e-05 ] [ -1.61e-05 2.38e-05 4.55e-05 ] [ 7.1e-06 -4.2e-05 3.2e-05 ] [ 1.04e-05 5.35e-05 -2.85e-05 ] [ 8.8e-06 -4e-07 7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.618198387008e-14 -5.591596406592e-14 -9.084341439936e-14 ] [ -2.579504359488e-14 3.813180357504e-14 7.28990362464e-14 ] [ 1.137545400768e-14 -6.72914180736e-14 5.12696518656e-14 ] [ 1.666263685632e-14 8.57164492128e-14 -4.56620336928e-14 ] [ 1.409915426304e-14 -6.408706483200001e-16 1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }