{ "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" [ [ 1.569029 2.409456 2.459016 ] [ 1.280031 0.1374919 2.779238 ] [ 3.588101 1.133333 2.932926 ] [ 4.931515 2.722575 2.426382 ] [ 3.330231 3.38172 3.93095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.569029e-10 2.409456e-10 2.459016e-10 ] [ 1.280031e-10 1.374919e-11 2.779238e-10 ] [ 3.588101e-10 1.133333e-10 2.932926e-10 ] [ 4.931515000000001e-10 2.722575e-10 2.426382e-10 ] [ 3.330231e-10 3.38172e-10 3.93095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4295312 1.1220069 0.4511726 ] [ -0.3360307 -0.181809 -0.3143919 ] [ -1.8675392 -3.5442629 2.0506584 ] [ 2.150159 3.1220306 -2.1652249 ] [ -1.3761204 -0.5179656 -0.0222142 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.290361467344169e-09 1.797653223556284e-09 7.2285819166555e-10 ] [ -5.383805314110586e-10 -2.912901292510272e-10 -5.037113519488915e-10 ] [ -2.992127644667535e-09 -5.678535156348809e-09 3.285516945727135e-09 ] [ 3.444934480802707e-09 5.002044436742196e-09 -3.469072713554018e-09 ] [ -2.204787932285945e-09 -8.298723746986445e-10 -3.559107188977536e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -13.590479 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.177434771927336e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0009634 2.5489027 2.3127519 ] [ 1.4115388 0.2545134 2.5768049 ] [ 3.5227464 0.9684936 3.4220318 ] [ 4.3944395 2.7520517 2.0429552 ] [ 3.3692189 3.2606145 4.1739682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0009634e-10 2.548902700000001e-10 2.3127519e-10 ] [ 1.4115388e-10 2.545134e-11 2.5768049e-10 ] [ 3.5227464e-10 9.684936e-11 3.4220318e-10 ] [ 4.3944395e-10 2.7520517e-10 2.0429552e-10 ] [ 3.3692189e-10 3.2606145e-10 4.1739682e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.76e-05 8.7e-06 2.4e-06 ] [ -2.8e-06 -3.08e-05 -2.14e-05 ] [ -1.97e-05 3.5e-06 2.77e-05 ] [ 1.81e-05 7.7e-06 -2.86e-05 ] [ 2.2e-05 1.09e-05 2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.819830852608e-14 1.393893660096e-14 3.84522388992e-15 ] [ -4.48609453824e-15 -4.934703992064001e-14 -3.428657968511999e-14 ] [ -3.156287942976e-14 5.6076181728e-15 4.438029239616e-14 ] [ 2.899939683648e-14 1.233675998016e-14 -4.582225135488e-14 ] [ 3.52478856576e-14 1.746372516672e-14 3.2043532416e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.5414 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.650224435530112e-18 } }