{ "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" [ [ 1.201304 1.645112 1.368441 ] [ 2.96083 0.196256 2.000233 ] [ 1.817638 2.196428 3.68098 ] [ 1.740873 3.89811 0.9150282 ] [ 4.00836 2.276208 0.7214657 ] [ 3.949621 2.27126 3.236775 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.201304e-10 1.645112e-10 1.368441e-10 ] [ 2.96083e-10 1.96256e-11 2.000233e-10 ] [ 1.817638e-10 2.196428e-10 3.68098e-10 ] [ 1.740873e-10 3.89811e-10 9.150282e-11 ] [ 4.00836e-10 2.276208e-10 7.214657e-11 ] [ 3.949621e-10 2.27126e-10 3.236775e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5930785 0.6494713 0.6873549 ] [ 2.9186376 4.265345 -0.6099761 ] [ -2.9989246 -0.0103232 0.389209 ] [ -0.3346828 -0.0568661 -0.3658484 ] [ -0.7772985 -2.6194362 3.5199524 ] [ 1.7853469 -2.2281908 -3.6206917 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.50216514827769e-10 1.040567741313604e-09 1.101263960045407e-09 ] [ 4.676172965833838e-09 6.833836094948729e-09 -9.772894547184474e-10 ] [ -4.804806921247796e-09 -1.65395898281088e-11 6.23581565542506e-10 ] [ -5.362209619616952e-10 -9.110953668670739e-11 -5.861537580662856e-10 ] [ -1.245369494343249e-09 -4.196799473893751e-09 5.639585488072222e-09 ] [ 2.860441086764334e-09 -3.569955235853767e-09 -5.800987640657737e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.320285 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.813709611722069e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1523778 2.1578507 1.6857109 ] [ 3.1283682 0.947881 1.14351 ] [ 1.9490422 2.6372262 3.8547594 ] [ -0.0117498 3.5753922 0.3060613 ] [ 5.4834078 1.7063031 1.4785495 ] [ 3.9771798 1.4587209 3.4543317 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1523778e-10 2.1578507e-10 1.6857109e-10 ] [ 3.1283682e-10 9.47881e-11 1.14351e-10 ] [ 1.9490422e-10 2.6372262e-10 3.8547594e-10 ] [ -1.17498e-12 3.5753922e-10 3.060613e-11 ] [ 5.483407800000001e-10 1.7063031e-10 1.4785495e-10 ] [ 3.9771798e-10 1.4587209e-10 3.4543317e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.12e-05 2.39e-05 1.06e-05 ] [ -2.34e-05 -3.44e-05 -0.0001152 ] [ 7.7e-06 2.39e-05 1.55e-05 ] [ -3.3e-05 -7.9e-06 -8e-06 ] [ 6.21e-05 -0.0 1.67e-05 ] [ 1.78e-05 -5.5e-06 8.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.998791098079999e-14 3.82920215526e-14 1.69830723204e-14 ] [ -3.749093323559999e-14 -5.51148762096e-14 -1.845707482368e-13 ] [ 1.23367600818e-14 3.82920215526e-14 2.4833737827e-14 ] [ -5.287182892199999e-14 -1.26571954086e-14 -1.2817413072e-14 ] [ 9.949516897139999e-14 0.0 2.67563497878e-14 ] [ 2.851874408519999e-14 -8.811971486999999e-15 1.28975219037e-13 ] ] } "relaxed-potential-energy" { "source-value" -13.812132 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.212947515612369e-18 } }