{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.5408338 -0.3832066 -4.3002017 ] [ -7.4235117 0.3456463 8.3833084 ] [ -0.388962 -10.6921183 -0.8456001 ] [ 7.3633342 1.0795867 6.6313228 ] [ -0.9313834 4.0094977 -0.8827821 ] [ 10.9862449 0.4245026 -11.9760204 ] [ -1.0648883 5.2160916 2.989973 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.368392423649842e-08 -6.139646554562573e-10 -6.889682628464415e-09 ] [ -1.189377688997526e-08 5.537864209260231e-10 1.343154072343626e-08 ] [ -6.231858227796095e-10 -1.713066196708784e-08 -1.354800710766142e-09 ] [ 1.179736190637707e-08 1.729688570866623e-09 1.062455035513799e-08 ] [ -1.492240708481215e-09 6.423923476091372e-09 -1.414372841880728e-09 ] [ 1.760190472916324e-08 6.80128141188814e-10 -1.918769989510386e-08 ] [ -1.706139138023457e-09 8.357100013471265e-09 4.790464837423239e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.193247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.633138203343974e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4544444 2.9514543 1.2474217 ] [ 2.0795618 2.6948585 3.7652458 ] [ 3.2528378 1.2194538 1.9970981 ] [ 5.6466607 3.6672431 3.431946 ] [ 3.289484 4.5017344 1.1714527 ] [ 4.979439 2.7399266 1.3253745 ] [ 3.4653392 4.6439102 3.6071202 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4544444e-10 2.9514543e-10 1.2474217e-10 ] [ 2.0795618e-10 2.6948585e-10 3.7652458e-10 ] [ 3.2528378e-10 1.2194538e-10 1.9970981e-10 ] [ 5.6466607e-10 3.6672431e-10 3.431946e-10 ] [ 3.289484e-10 4.5017344e-10 1.1714527e-10 ] [ 4.979439e-10 2.7399266e-10 1.3253745e-10 ] [ 3.4653392e-10 4.6439102e-10 3.6071202e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.11e-05 -3.9e-06 3e-06 ] [ -2.61e-05 -4.6e-06 -2.02e-05 ] [ -8.4e-06 -1.59e-05 -7.1e-06 ] [ 1.72e-05 -8e-07 -1.75e-05 ] [ -3.28e-05 2.9e-06 1.39e-05 ] [ 1.99e-05 -2.9e-06 2.1e-05 ] [ 1.91e-05 2.52e-05 6.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.778416049088e-14 -6.24848882112e-15 4.8065298624e-15 ] [ -4.181680980288e-14 -7.370012455680001e-15 -3.236396774016e-14 ] [ -1.345828361472e-14 -2.547460827072e-14 -1.137545400768e-14 ] [ 2.755743787776e-14 -1.28174129664e-15 -2.8038090864e-14 ] [ -5.255139316223999e-14 4.646312200320001e-15 2.227025502912e-14 ] [ 3.188331475392e-14 -4.646312200320001e-15 3.36457090368e-14 ] [ 3.060157345728e-14 4.037485084416e-14 1.105501868352e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }