{ "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" [ [ 0.0417064 1.393533 2.342657 ] [ 0.9221083 2.569653 0.2410471 ] [ 1.810038 0.5140043 0.5075901 ] [ 2.608454 2.928842 0.8878785 ] [ 2.606177 1.867368 2.693771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.17064e-12 1.393533e-10 2.342657e-10 ] [ 9.221083e-11 2.569653e-10 2.410471e-11 ] [ 1.810038e-10 5.140043e-11 5.075901e-11 ] [ 2.608454e-10 2.928842e-10 8.878785000000001e-11 ] [ 2.606177e-10 1.867368e-10 2.693771e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1117983 -1.3248699 0.550363 ] [ -17.2044781 -1.2573811 -5.635481 ] [ 0.8249323 -2.0483426 1.3073762 ] [ 18.6873893 8.0083031 -0.4211573 ] [ -1.1960451 -3.3777096 4.1988991 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.781297257980922e-09 -2.122675596869916e-09 8.81778738818142e-10 ] [ -2.756461281198471e-08 -2.014546618453217e-09 -9.029035979550955e-09 ] [ 1.321687255691878e-09 -3.281806652146808e-09 2.094647599487711e-09 ] [ 2.994049848692162e-08 1.283071610480976e-08 -6.747683852985282e-10 ] [ -1.916275512430193e-09 -5.411687397557487e-09 6.727378026543629e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.0331434 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.287051465305132e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1296747 1.3551029 2.2512977 ] [ 0.503064 2.6225328 0.1274454 ] [ 1.9126714 0.6890224 0.6943524 ] [ 2.9082285 2.9370796 0.7379916 ] [ 2.5348451 1.6696627 2.8618566 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.296747e-11 1.3551029e-10 2.2512977e-10 ] [ 5.030639999999999e-11 2.6225328e-10 1.274454e-11 ] [ 1.9126714e-10 6.890224e-11 6.943524e-11 ] [ 2.9082285e-10 2.9370796e-10 7.379916e-11 ] [ 2.5348451e-10 1.6696627e-10 2.8618566e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.29e-05 6.3e-06 1.05e-05 ] [ -3.06e-05 -1.72e-05 -3.37e-05 ] [ -2.34e-05 -2e-07 6.6e-06 ] [ 3.47e-05 2.79e-05 2.08e-05 ] [ -3.5e-06 -1.68e-05 -4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.66898449186e-14 1.00937127942e-14 1.6822854657e-14 ] [ -4.90266050004e-14 -2.75574381048e-14 -5.399335256579999e-14 ] [ -3.749093323559999e-14 -3.204353268e-16 1.05743657844e-14 ] [ 5.55955291998e-14 4.470072808859999e-14 3.332527398719999e-14 ] [ -5.607618218999999e-15 -2.691656745119999e-14 -6.568924199399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.312367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.293093998463268e-18 } }