{ "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" [ [ 0.7607129 0.1029019 2.480933 ] [ 0.9158836 2.552597 0.2381701 ] [ 0.8989231 2.268448 2.632769 ] [ 2.109562 0.2713555 0.0459784 ] [ 2.969591 1.985029 0.1686784 ] [ 2.973458 2.362165 2.304699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.607129000000001e-11 1.029019e-11 2.480933e-10 ] [ 9.158836e-11 2.552597e-10 2.381701e-11 ] [ 8.989231e-11 2.268448e-10 2.632769e-10 ] [ 2.109562e-10 2.713555e-11 4.59784e-12 ] [ 2.969591e-10 1.985029e-10 1.686784e-11 ] [ 2.973458e-10 2.362165e-10 2.304699e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7155291 -5.8412031 -0.143108 ] [ -7.8403601 6.5970326 -0.1144648 ] [ -8.2756987 4.9227921 0.8692279 ] [ -7.2995705 -25.2869169 -1.5765587 ] [ 13.9178862 18.5695306 -2.3532117 ] [ 10.2132721 1.0387646 3.3181153 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.146404004967049e-09 -9.358639121268364e-09 -2.29284293738472e-10 ] [ -1.25616417543659e-08 1.056961148545627e-08 -1.833928279754832e-10 ] [ -1.325913108716417e-08 7.88718247665979e-09 1.392656631000888e-09 ] [ -1.16952012933357e-08 -4.051410740307971e-08 -2.525925511269416e-09 ] [ 2.229891206431105e-08 2.9751668031668e-08 -3.770260800595417e-09 ] [ 1.636346591530411e-08 1.664284370346356e-09 5.316206802577899e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.9872505 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.279698612100482e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6529519 -0.138976 2.2362272 ] [ 0.6108157 3.1096701 0.2103383 ] [ 0.8500571 2.312731 2.5922303 ] [ 2.2587203 -0.346024 0.2589098 ] [ 2.895924 2.0489385 0.0729417 ] [ 3.3596615 2.5561568 2.5005806 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.529519e-11 -1.38976e-11 2.2362272e-10 ] [ 6.108157e-11 3.1096701e-10 2.103383e-11 ] [ 8.500571e-11 2.312731e-10 2.5922303e-10 ] [ 2.2587203e-10 -3.46024e-11 2.589098e-11 ] [ 2.895924e-10 2.0489385e-10 7.29417e-12 ] [ 3.3596615e-10 2.5561568e-10 2.5005806e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-06 -1.02e-05 1.76e-05 ] [ -6.9e-06 2.39e-05 2e-07 ] [ 1.4e-06 2e-06 -5.8e-06 ] [ 7.3e-06 -1.9e-06 -9.9e-06 ] [ 7.1e-06 -1.45e-05 -9.1e-06 ] [ -1.09e-05 6e-07 7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.204353268e-15 -1.63422016668e-14 2.81983087584e-14 ] [ -1.10550187746e-14 3.82920215526e-14 3.204353268e-16 ] [ 2.2430472876e-15 3.204353268e-15 -9.2926244772e-15 ] [ 1.16958894282e-14 -3.0441356046e-15 -1.58615486766e-14 ] [ 1.13754541014e-14 -2.3231561193e-14 -1.45798073694e-14 ] [ -1.74637253106e-14 9.613059803999998e-16 1.15356717648e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.273917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767586619505538e-18 } }