{ "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" [ [ 0.1226517 0.1643142 2.08525 ] [ 0.897513 2.739377 0.422181 ] [ 0.4967103 2.508008 2.34433 ] [ 2.384655 1.344784 0.6822557 ] [ 2.452846 2.947826 1.504929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.226517e-11 1.643142e-11 2.08525e-10 ] [ 8.97513e-11 2.739377e-10 4.22181e-11 ] [ 4.967103e-11 2.508008e-10 2.34433e-10 ] [ 2.384655e-10 1.344784e-10 6.822557000000001e-11 ] [ 2.452846e-10 2.947826e-10 1.504929e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1475871 -1.7173276 0.8327077 ] [ -16.1759941 6.9167091 -23.4052472 ] [ -8.4493366 -1.5122093 15.1745984 ] [ 5.8599539 -27.9082385 -10.8028805 ] [ 18.9129639 24.2210662 18.2008216 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.364606011516717e-10 -2.751462130974574e-09 1.33414480890014e-09 ] [ -2.591679956521874e-08 1.108178961289461e-08 -3.749933986788466e-08 ] [ -1.353732956178976e-08 -2.422826386216333e-09 2.431238678650909e-08 ] [ 9.38868113754578e-09 -4.471392725241046e-08 -1.730812257439622e-08 ] [ 3.030190859061439e-08 3.88064259964891e-08 2.916093084687165e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.4908481 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.797308454184101e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5920775 0.2535233 2.1473178 ] [ 0.7472732 2.935667 0.0536559 ] [ 0.1637276 2.6416561 2.5276028 ] [ 2.2381409 0.8923495 0.440375 ] [ 2.6131568 2.9811134 1.8699942 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.920775e-11 2.535233e-11 2.1473178e-10 ] [ 7.472732e-11 2.935667e-10 5.36559e-12 ] [ 1.637276e-11 2.6416561e-10 2.5276028e-10 ] [ 2.2381409e-10 8.923495e-11 4.40375e-11 ] [ 2.6131568e-10 2.9811134e-10 1.8699942e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.9e-06 3.4e-06 7.4e-06 ] [ 3.7e-06 8.6e-06 -9.9e-06 ] [ 1.05e-05 -1.29e-05 -7.8e-06 ] [ -1.21e-05 8.8e-06 8.9e-06 ] [ -8e-06 -7.9e-06 1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.45284206272e-15 5.44740051072e-15 1.185610699392e-14 ] [ 5.928053496960001e-15 1.377871893888e-14 -1.586154854592e-14 ] [ 1.68228545184e-14 -2.066807840832e-14 -1.249697764224e-14 ] [ -1.938633711168e-14 1.409915426304e-14 1.425937192512e-14 ] [ -1.28174129664e-14 -1.265719530432e-14 2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.977047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.758716806882278e-18 } }