{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.4713657 3.5732668 -0.582922 ] [ 0.3448395 0.7863498 3.1067084 ] [ -6.3233617 -2.5344015 -0.0732483 ] [ 1.3079744 -0.6036785 3.0712928 ] [ -2.1367922 0.5088686 -1.0467164 ] [ 3.4331739 -0.1523977 1.5737251 ] [ -0.0971995 -1.5780075 -6.0488396 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.561740966787026e-09 5.725004526840829e-09 -9.339440001499778e-10 ] [ 5.524937848283617e-10 1.259871265330756e-09 4.977495566122975e-09 ] [ -1.013114228060214e-08 -4.060558831020452e-09 -1.173567137733447e-10 ] [ 2.095606004284908e-09 -9.67199579179613e-10 4.920753519791371e-09 ] [ -3.423518506347797e-09 8.152973739792269e-10 -1.677024544687941e-09 ] [ 5.500550957720757e-09 -2.441680320036922e-10 2.521385562786142e-09 ] [ -1.557307664534496e-10 -2.528246723947056e-09 -9.691309390089225e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.023515 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.848991408243811e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1472094 1.8522814 3.0737569 ] [ 2.9643709 5.7389356 2.6685324 ] [ 2.6699939 3.6307983 1.5206914 ] [ 4.4161996 2.0831843 2.2695115 ] [ 5.8091824 3.2176564 3.8884657 ] [ 4.9177901 4.4688949 2.020777 ] [ 3.4485566 3.7137401 3.8862381 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1472094e-10 1.8522814e-10 3.0737569e-10 ] [ 2.9643709e-10 5.7389356e-10 2.6685324e-10 ] [ 2.6699939e-10 3.6307983e-10 1.5206914e-10 ] [ 4.4161996e-10 2.0831843e-10 2.2695115e-10 ] [ 5.8091824e-10 3.2176564e-10 3.8884657e-10 ] [ 4.917790100000001e-10 4.4688949e-10 2.020777e-10 ] [ 3.4485566e-10 3.7137401e-10 3.8862381e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.7e-06 9e-07 4.3e-06 ] [ -4.9e-06 4e-07 9.1e-06 ] [ 6.6e-06 3.6e-06 -7.1e-06 ] [ -2.4e-06 -1e-07 -1.4e-06 ] [ -4e-06 -9e-07 3.9e-06 ] [ -1.6e-06 -8.1e-06 -7.9e-06 ] [ -3e-07 4.1e-06 -8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.073458335936e-14 1.44195895872e-15 6.889359469440001e-15 ] [ -7.850665441919999e-15 6.408706483200001e-16 1.457980724928e-14 ] [ 1.057436569728e-14 5.76783583488e-15 -1.137545400768e-14 ] [ -3.84522388992e-15 -1.6021766208e-16 -2.24304726912e-15 ] [ -6.4087064832e-15 -1.44195895872e-15 6.24848882112e-15 ] [ -2.56348259328e-15 -1.297763062848e-14 -1.265719530432e-14 ] [ -4.8065298624e-16 6.568924145279999e-15 -1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -29.715697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.76097950041767e-18 } }