{ "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" [ [ 1.137105 0.4960836 2.336745 ] [ 0.1995221 2.603398 2.709633 ] [ 1.958667 0.0128645 0.3845919 ] [ 2.315861 1.899112 1.511593 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.137105e-10 4.960836e-11 2.336745e-10 ] [ 1.995221e-11 2.603398e-10 2.709633e-10 ] [ 1.958667e-10 1.28645e-12 3.845919e-11 ] [ 2.315861e-10 1.899112e-10 1.511593e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.933567 -3.8176043 4.778657 ] [ -0.6305336 0.7481437 0.2225212 ] [ 0.6420767 -2.6512664 -3.8606043 ] [ 3.9220239 5.7207269 -1.1405739 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.302269083750393e-09 -6.116476356925549e-09 7.656252524222266e-09 ] [ -1.010226192548859e-09 1.198658345138809e-09 3.56518264272361e-10 ] [ 1.028720277500415e-09 -4.247797041592581e-09 -6.18536995161995e-09 ] [ 6.283774998798837e-09 9.16561489316166e-09 -1.827400836874677e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.9375881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.308711596160293e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5168786 0.0931035 2.3960285 ] [ 0.7075558 2.3304997 2.6955089 ] [ 2.0980199 0.1752298 0.7757707 ] [ 2.2887009 2.412625 1.0752548 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.168786e-11 9.310350000000001e-12 2.3960285e-10 ] [ 7.075558e-11 2.3304997e-10 2.6955089e-10 ] [ 2.0980199e-10 1.752298e-11 7.757707000000001e-11 ] [ 2.2887009e-10 2.412625e-10 1.0752548e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-07 2.9e-06 -1.3e-06 ] [ 1.3e-06 -2.3e-06 -4e-07 ] [ 2e-07 -5e-07 1.2e-06 ] [ -1.9e-06 -2e-07 4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706483200001e-16 4.646312200320001e-15 -2.08282960704e-15 ] [ 2.08282960704e-15 -3.68500622784e-15 -6.408706483200001e-16 ] [ 3.2043532416e-16 -8.010883104e-16 1.92261194496e-15 ] [ -3.04413557952e-15 -3.2043532416e-16 6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -6.4872904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039378501122028e-18 } }