{ "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" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9482824 -3.762119 -3.8193606 ] [ 0.9808816 -0.4527418 6.4018933 ] [ -4.4726222 3.9061044 -1.6436653 ] [ -0.479297 -1.2188041 -1.3640045 ] [ 2.8280528 -0.9132491 2.2148586 ] [ 1.4191509 0.1020233 -3.7567934 ] [ 2.6721163 2.3387863 1.9670717 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.723669132796114e-09 -6.027579106467476e-09 -6.11929025972466e-09 ] [ 1.571545567292897e-09 -7.253723272189096e-10 1.025696377411616e-08 ] [ -7.165930722511062e-09 6.258269148084011e-09 -2.633442116080218e-09 ] [ -7.679184478195775e-10 -1.952739434355186e-09 -2.185376120565994e-09 ] [ 4.531040078547979e-09 -1.463186356986642e-09 3.548594667297819e-09 ] [ 2.273730393367279e-09 1.634593460368646e-10 -6.019046554655742e-09 ] [ 4.281202263918599e-09 3.747148730907335e-09 3.151596289177311e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.622184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.342732134983583e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6168941 2.0834975 2.6731518 ] [ 2.4948765 2.3820475 4.7891051 ] [ 1.5519944 4.2319706 1.826336 ] [ 3.7573298 1.9194016 1.8895051 ] [ 4.641202 2.4247022 3.9354605 ] [ 3.7825042 4.1094653 1.2372156 ] [ 4.872788 4.6066273 3.212401 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6168941e-10 2.0834975e-10 2.6731518e-10 ] [ 2.4948765e-10 2.3820475e-10 4.7891051e-10 ] [ 1.5519944e-10 4.2319706e-10 1.826336e-10 ] [ 3.7573298e-10 1.9194016e-10 1.8895051e-10 ] [ 4.641202e-10 2.4247022e-10 3.9354605e-10 ] [ 3.7825042e-10 4.1094653e-10 1.2372156e-10 ] [ 4.872788e-10 4.606627300000001e-10 3.212401e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.5e-06 -1.7e-06 -7.9e-06 ] [ 2e-06 1.6e-06 -5.6e-06 ] [ -2e-06 7e-07 2.6e-06 ] [ -7e-07 -1.6e-06 5e-06 ] [ 7.8e-06 2.7e-06 3.9e-06 ] [ -1.6e-06 -4e-07 3.7e-06 ] [ 2.1e-06 -1.2e-06 -1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2016324656e-14 -2.72370025536e-15 -1.265719530432e-14 ] [ 3.2043532416e-15 2.56348259328e-15 -8.972189076479999e-15 ] [ -3.2043532416e-15 1.12152363456e-15 4.16565921408e-15 ] [ -1.12152363456e-15 -2.56348259328e-15 8.010883104e-15 ] [ 1.249697764224e-14 4.32587687616e-15 6.24848882112e-15 ] [ -2.56348259328e-15 -6.408706483200001e-16 5.928053496960001e-15 ] [ 3.36457090368e-15 -1.92261194496e-15 -2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }