{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1976254 -1.4867193 -1.8457438 ] [ -0.9721636 0.9066736 0.1597181 ] [ 1.1861332 0.6699543 -0.3902679 ] [ -0.7961721 -1.9121933 -0.133073 ] [ 0.6014608 -0.4688197 0.162338 ] [ 0.4978192 1.8586893 1.5043485 ] [ 0.6805478 0.4324151 0.54268 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.918807416356248e-09 -2.381986904152142e-09 -2.957207564346551e-09 ] [ -1.557577791512763e-09 1.452651244616571e-09 2.558966057385965e-10 ] [ 1.900394882194691e-09 1.073385116464429e-09 -6.252781052287123e-10 ] [ -1.27560832475324e-09 -3.063671399710401e-09 -2.132064494597184e-10 ] [ 9.636464320876648e-10 -7.511319627104698e-10 2.600941482674305e-10 ] [ 7.975942836253594e-10 2.977948541791117e-09 2.410231996235549e-09 ] [ 1.090357774496874e-09 6.928053637008941e-10 8.694692085757442e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.078861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.736335180409291e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0598392 1.9871429 1.1288429 ] [ 2.179524 3.7448345 2.5778294 ] [ 5.0551804 3.3396025 0.7370837 ] [ 3.733698 0.2130633 2.5721288 ] [ 5.0713882 1.018562 4.4845574 ] [ 5.4702529 3.4535073 4.5716218 ] [ 4.4607012 4.6011913 2.7418286 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0598392e-10 1.9871429e-10 1.1288429e-10 ] [ 2.179524e-10 3.7448345e-10 2.5778294e-10 ] [ 5.055180400000001e-10 3.3396025e-10 7.370837e-11 ] [ 3.733698e-10 2.130633e-11 2.5721288e-10 ] [ 5.071388200000001e-10 1.018562e-10 4.4845574e-10 ] [ 5.4702529e-10 3.4535073e-10 4.5716218e-10 ] [ 4.4607012e-10 4.6011913e-10 2.7418286e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.5e-06 -3.8e-06 0.0 ] [ -2.68e-05 2.49e-05 1.61e-05 ] [ 1.48e-05 5.3e-06 -1.71e-05 ] [ 9.5e-06 -3.8e-06 4.4e-06 ] [ 7.6e-06 -3.1e-06 1.42e-05 ] [ -1.33e-05 -2.14e-05 -8.5e-06 ] [ 6e-07 2e-06 -9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2016324656e-14 -6.08827115904e-15 0.0 ] [ -4.293833343744e-14 3.989419785791999e-14 2.579504359488e-14 ] [ 2.371221398784e-14 8.491536090240001e-15 -2.739722021568e-14 ] [ 1.52206778976e-14 -6.08827115904e-15 7.04957713152e-15 ] [ 1.217654231808e-14 -4.96674752448e-15 2.275090801536e-14 ] [ -2.130894905664e-14 -3.428657968511999e-14 -1.36185012768e-14 ] [ 9.6130597248e-16 3.2043532416e-15 -1.457980724928e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.075996 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.376746805127432e-18 } }