{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 5.517305 2.823831 2.520754 ] [ 3.206819 2.056835 2.580452 ] [ 4.931014 5.152147 1.608787 ] [ 3.498861 3.411494 1.086096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.517305000000001e-10 2.823831e-10 2.520754e-10 ] [ 3.206819e-10 2.056835e-10 2.580452e-10 ] [ 4.931014e-10 5.152147000000001e-10 1.608787e-10 ] [ 3.498861e-10 3.411494e-10 1.086096e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4250085 0.5684283 -0.2786827 ] [ -0.3144568 -2.7784241 3.340915 ] [ 0.2759338 -0.5604909 0.4208829 ] [ 0.4635315 2.7704867 -3.4831153 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.809386823412769e-10 9.107225328610886e-10 -4.464989065614201e-10 ] [ -5.038153332115814e-10 -4.451526135687282e-09 5.352735905080032e-09 ] [ 4.420946832485031e-10 -8.980054161511507e-10 6.743287424745043e-10 ] [ 7.426593323043552e-10 4.438809018977344e-09 -5.580565901210778e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.975584620327121 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.767412111900157e-19 } "relaxed-configuration-positions" { "source-value" [ [ 5.5511053 2.9926678 2.9691967 ] [ 3.5069592 1.9664737 2.412658 ] [ 5.0700308 4.7556905 1.4853992 ] [ 3.0259038 3.729475 0.9288351 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.551105299999999e-10 2.9926678e-10 2.9691967e-10 ] [ 3.5069592e-10 1.9664737e-10 2.412658e-10 ] [ 5.0700308e-10 4.7556905e-10 1.4853992e-10 ] [ 3.0259038e-10 3.729475e-10 9.288351e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 -4.9e-06 8.7e-06 ] [ 1.5e-05 -2.02e-05 1.95e-05 ] [ 3.8e-06 -1.6e-06 1e-07 ] [ -2.24e-05 2.66e-05 -2.84e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.76783583488e-15 -7.850665441919999e-15 1.393893660096e-14 ] [ 2.4032649312e-14 -3.236396774016e-14 3.12424441056e-14 ] [ 6.08827115904e-15 -2.56348259328e-15 1.6021766208e-16 ] [ -3.588875630592e-14 4.261789811328e-14 -4.550181603071999e-14 ] ] } "relaxed-potential-energy" { "source-value" -3.86421462032712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.19115432244166e-19 } }