{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.91701 1.98827 2.508844 ] [ 2.572173 1.794465 4.860558 ] [ 4.363165 1.510923 1.91691 ] [ 4.651171 2.095892 4.214607 ] [ 5.448722 3.893309 2.444809 ] [ 3.326625 3.729664 3.343147 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.91701e-10 1.98827e-10 2.508844e-10 ] [ 2.572173e-10 1.794465e-10 4.860558000000001e-10 ] [ 4.363165000000001e-10 1.510923e-10 1.91691e-10 ] [ 4.651171e-10 2.095892e-10 4.214607e-10 ] [ 5.448722e-10 3.893309e-10 2.444809e-10 ] [ 3.326625e-10 3.729664e-10 3.343147e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4531017 -0.2447743 -0.0799877 ] [ -1.396893 -0.3974072 0.2445832 ] [ -0.01288 -1.1277009 -0.7367241 ] [ 1.9110587 -0.691119 0.0020332 ] [ -0.1099238 -0.7065361 -0.3377474 ] [ -1.8444636 3.1675374 0.9078428 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.328125590565677e-09 -3.921716640637061e-10 -1.281544239474018e-10 ] [ -2.238069324798161e-09 -6.367165300233648e-10 3.918654881089488e-10 ] [ -2.063603504592e-11 -1.80677603212077e-09 -1.180362138724679e-09 ] [ 3.061853595342416e-09 -1.107294713113446e-09 3.2575455322488e-12 ] [ -1.761173438804892e-10 -1.131995630497487e-09 -5.411309924742515e-10 ] [ -2.955156482183522e-09 5.074954409601111e-09 1.454524521505135e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.491871719227609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.321853825147188e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.042194 1.9785653 2.380134 ] [ 2.7513845 2.077011 4.7025716 ] [ 4.2965122 1.5061173 1.9412556 ] [ 5.0218576 1.7591609 4.2416848 ] [ 5.2003837 3.6440651 2.7180002 ] [ 2.9665341 4.0476034 3.3052289 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.042194e-10 1.9785653e-10 2.380134e-10 ] [ 2.7513845e-10 2.077011e-10 4.7025716e-10 ] [ 4.2965122e-10 1.5061173e-10 1.9412556e-10 ] [ 5.0218576e-10 1.7591609e-10 4.2416848e-10 ] [ 5.2003837e-10 3.644065100000001e-10 2.7180002e-10 ] [ 2.9665341e-10 4.0476034e-10 3.3052289e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 -3.8e-06 -7.7e-06 ] [ -2.06e-05 -7.4e-06 3.02e-05 ] [ 2.23e-05 5.3e-06 1.06e-05 ] [ -1.9e-06 6.9e-06 -3.11e-05 ] [ -1e-07 -1.73e-05 -5.4e-06 ] [ -0.0 1.62e-05 3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-16 -6.088271209199999e-15 -1.23367600818e-14 ] [ -3.300483866039999e-14 -1.18561070916e-14 4.838573434679999e-14 ] [ 3.572853893819999e-14 8.4915361602e-15 1.69830723204e-14 ] [ -3.0441356046e-15 1.10550187746e-14 -4.982769331739999e-14 ] [ -1.602176634e-16 -2.77176557682e-14 -8.6517538236e-15 ] [ 0.0 2.59552614708e-14 5.2871828922e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.509304719227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.64508222647324e-18 } }