{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.8942735 -2.4140433 -10.8064462 ] [ 2.5627783 -26.6518453 16.1011928 ] [ -18.3271078 28.2207562 -6.0000415 ] [ -8.849359 40.4964828 -19.9787789 ] [ 20.7194151 -39.6513504 20.6840738 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.239314008105399e-09 -3.867723768724252e-09 -1.731383559821809e-08 ] [ 4.106023510382242e-09 -4.270096379264272e-08 2.579695488368903e-08 ] [ -2.936326388595914e-08 4.521463617745063e-08 -9.613126294330311e-09 ] [ -1.41782362156776e-08 6.488251850134289e-08 -3.200953272943222e-08 ] [ 3.319616274336677e-08 -6.352846711742654e-08 3.313953973829158e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2862492 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.867328315741193e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5918654 1.8099784 0.8631528 ] [ 1.162832 1.7484036 3.5400358 ] [ 0.5754166 3.9521398 2.1230599 ] [ 2.5402967 5.6160145 2.4763245 ] [ 3.2426458 3.1144697 2.531272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5918654e-10 1.8099784e-10 8.631528000000001e-11 ] [ 1.162832e-10 1.7484036e-10 3.5400358e-10 ] [ 5.754166e-11 3.9521398e-10 2.1230599e-10 ] [ 2.5402967e-10 5.616014500000001e-10 2.4763245e-10 ] [ 3.2426458e-10 3.1144697e-10 2.531272e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.08e-05 1.28e-05 -3.4e-06 ] [ -1.36e-05 -7.47e-05 5.79e-05 ] [ -4.71e-05 3.42e-05 -3.72e-05 ] [ 2.12e-05 3.6e-05 -2.7e-06 ] [ 2.87e-05 -8.2e-06 -1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.73035076472e-14 2.05078609152e-14 -5.4474005556e-15 ] [ -2.17896022224e-14 -1.196825945598e-13 9.276602710859999e-14 ] [ -7.546251946139999e-14 5.479444088279999e-14 -5.96009707848e-14 ] [ 3.39661446408e-14 5.7678358824e-14 -4.3258769118e-15 ] [ 4.598246939579999e-14 -1.31378483988e-14 -2.33917788564e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.624493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.663537423669656e-18 } }