{ "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" [ [ 0.563951 0.9225225 1.195567 ] [ 1.348432 0.3073599 2.755625 ] [ 0.2422324 2.903648 2.041824 ] [ 2.040932 0.0344744 0.838059 ] [ 2.055265 2.344707 1.01543 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.63951e-11 9.225225000000001e-11 1.195567e-10 ] [ 1.348432e-10 3.073599e-11 2.755625000000001e-10 ] [ 2.422324e-11 2.903648e-10 2.041824e-10 ] [ 2.040932e-10 3.447440000000001e-12 8.38059e-11 ] [ 2.055265e-10 2.344707e-10 1.01543e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.6895727 8.0233772 -7.2270062 ] [ 3.484041 -3.207678 14.1295632 ] [ -1.3263472 1.5587924 1.5541317 ] [ 15.3230086 -9.1769932 -7.2421324 ] [ 4.2088703 2.8025016 -1.2145563 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.475052658138429e-08 1.285486747560835e-08 -1.157894046741313e-08 ] [ 5.582049082097993e-09 -5.139266740995851e-09 2.263805600766627e-08 ] [ -2.125042492411325e-09 2.497460760536781e-09 2.489993495898697e-09 ] [ 2.455016634150105e-08 -1.470316407541689e-08 -1.160317531161434e-08 ] [ 6.74335365019657e-09 4.490102580267614e-09 -1.945933724537494e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.9903086 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.597532469369251e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1720495 0.9477955 0.8383684 ] [ 1.0222179 0.3459704 2.9931035 ] [ 0.627614 2.6517193 2.4560673 ] [ 2.4117631 0.1307377 1.0479975 ] [ 2.0171678 2.4364889 0.5109683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.720495e-11 9.477955e-11 8.383684e-11 ] [ 1.0222179e-10 3.459704e-11 2.9931035e-10 ] [ 6.27614e-11 2.6517193e-10 2.4560673e-10 ] [ 2.4117631e-10 1.307377e-11 1.0479975e-10 ] [ 2.0171678e-10 2.4364889e-10 5.109683000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.2e-06 1.1e-06 5.1e-06 ] [ -5.7e-06 -1.5e-06 -4.7e-06 ] [ -4e-07 1.9e-06 5.2e-06 ] [ 3.8e-06 -3.9e-06 2.2e-06 ] [ -3e-06 2.4e-06 -7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.331318496799998e-15 1.7623942974e-15 8.1711008334e-15 ] [ -9.1324068138e-15 -2.403264951e-15 -7.530230179799999e-15 ] [ -6.408706536e-16 3.0441356046e-15 8.331318496799998e-15 ] [ 6.088271209199999e-15 -6.248488872599999e-15 3.5247885948e-15 ] [ -4.806529901999999e-15 3.845223921599999e-15 -1.24969777452e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }