{ "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" [ [ 2.082752 2.058358 1.918508 ] [ 1.804708 3.969119 3.022657 ] [ 3.997636 1.573064 0.3548062 ] [ 3.986466 2.315414 3.180743 ] [ 3.658552 3.790773 1.50531 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.082752e-10 2.058358e-10 1.918508e-10 ] [ 1.804708e-10 3.969119e-10 3.022657e-10 ] [ 3.997636e-10 1.573064e-10 3.548062000000001e-11 ] [ 3.986466e-10 2.315414e-10 3.180743e-10 ] [ 3.658552e-10 3.790773e-10 1.50531e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5655781 -3.5844422 -1.8672117 ] [ -0.7033699 2.11754 1.1214705 ] [ -0.6428148 0.7080607 0.4551471 ] [ 1.667349 -1.2516751 2.4435931 ] [ 1.2444138 2.0105165 -2.152999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.508332629856485e-09 -5.742909491448918e-09 -2.991602931824223e-09 ] [ -1.126922809554434e-09 3.392673081608832e-09 1.796793816016887e-09 ] [ -1.029902844064228e-09 1.134438299647283e-09 7.292260426449197e-10 ] [ 2.671387586514259e-09 -2.005404582057502e-09 3.915067735568197e-09 ] [ 1.993770696960887e-09 3.221202532032643e-09 -3.449484662405779e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.800175 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.890596450634864e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0440956 1.5226189 2.056994 ] [ 1.9808193 3.8465275 2.6891326 ] [ 3.5749949 1.9677537 0.3258115 ] [ 3.8536129 2.4277762 3.3932592 ] [ 4.0765912 3.9420518 1.5168269 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0440956e-10 1.5226189e-10 2.056994e-10 ] [ 1.9808193e-10 3.8465275e-10 2.689132600000001e-10 ] [ 3.5749949e-10 1.9677537e-10 3.258115e-11 ] [ 3.8536129e-10 2.4277762e-10 3.3932592e-10 ] [ 4.0765912e-10 3.9420518e-10 1.5168269e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1851136 0.03535 0.0487704 ] [ 0.0108083 -0.0618046 -0.0430633 ] [ -0.1365314 0.1035653 -0.3037514 ] [ -0.1034362 0.1275881 0.2794136 ] [ 0.0440458 -0.2046988 0.0186308 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.965846821121229e-10 5.663694354528e-11 7.813879466706432e-11 ] [ 1.731680557059264e-11 -9.902188517789569e-11 -6.899501247449663e-11 ] [ -2.187474170850931e-10 1.659299023861382e-10 -4.866633916152691e-10 ] [ -1.65723061384393e-10 2.044186709122925e-10 4.476699374535629e-10 ] [ 7.056915100443266e-11 -3.27963631665815e-10 2.984983218680064e-11 ] ] } "relaxed-potential-energy" { "source-value" -14.039035 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.249301365559293e-18 } }