{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.68952 -0.6745249 -0.5440719 ] [ 0.0148079 0.7393787 0.7131992 ] [ 0.5411069 1.1657434 -0.6481815 ] [ -0.8106207 0.8331299 0.3964212 ] [ 0.4892545 -0.920007 0.0198119 ] [ -0.7641443 -1.9662769 -0.0167705 ] [ -0.1599243 0.8225568 0.0795917 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.10473283267568e-09 -1.080708033831186e-09 -8.716992853959846e-10 ] [ 2.37248713786086e-11 1.184615276817296e-09 1.142671093627493e-09 ] [ 8.669488316761744e-10 1.867726836719715e-09 -1.038501253891071e-09 ] [ -1.298757544576724e-09 1.334821258866757e-09 6.351367838622407e-10 ] [ 7.838721279793528e-10 -1.474013718516438e-09 3.17421632551446e-11 ] [ -1.224294142464286e-09 -3.150322905153954e-09 -2.6869303240497e-11 ] [ -2.562269766688061e-10 1.317881285097811e-09 1.275199620003378e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.53682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.450578977466388e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7289367 1.6141415 2.6824094 ] [ 1.6773885 3.3326477 4.0419174 ] [ 2.2038528 3.8211895 1.8106845 ] [ 4.9565057 2.4317965 2.1569547 ] [ 4.4287706 1.9439022 4.388025 ] [ 4.2787511 4.6315628 2.4695466 ] [ 3.7484847 4.1407069 4.7153233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7289367e-10 1.6141415e-10 2.6824094e-10 ] [ 1.6773885e-10 3.3326477e-10 4.0419174e-10 ] [ 2.2038528e-10 3.8211895e-10 1.8106845e-10 ] [ 4.9565057e-10 2.4317965e-10 2.1569547e-10 ] [ 4.4287706e-10 1.9439022e-10 4.388025e-10 ] [ 4.2787511e-10 4.631562800000001e-10 2.4695466e-10 ] [ 3.7484847e-10 4.1407069e-10 4.7153233e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.99e-05 1.13e-05 8.9e-06 ] [ -7.9e-06 3.46e-05 -2.9e-06 ] [ 5.1e-06 -2.67e-05 -3.12e-05 ] [ -5.88e-05 3.33e-05 -2.57e-05 ] [ 3.03e-05 -1.83e-05 1.34e-05 ] [ 1.98e-05 -2.43e-05 5e-06 ] [ -1.84e-05 -9.8e-06 3.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.790508135659999e-14 1.81045959642e-14 1.42593720426e-14 ] [ -1.26571954086e-14 5.54353115364e-14 -4.6463122386e-15 ] [ 8.1711008334e-15 -4.277811612779999e-14 -4.998791098079999e-14 ] [ -9.420798607919999e-14 5.33524819122e-14 -4.11759394938e-14 ] [ 4.854595201019999e-14 -2.93198324022e-14 2.14691668956e-14 ] [ 3.17230973532e-14 -3.893289220619999e-14 8.010883169999999e-15 ] [ -2.94800500656e-14 -1.57013310132e-14 5.207074060499999e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993289292598e-18 } }