{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4207328 -3.7204691 1.0905035 ] [ -0.1018768 -0.3325726 -1.3426113 ] [ -0.2265869 0.7043716 -0.1080546 ] [ 1.7491965 3.3486701 0.3601625 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.276264895317395e-09 -5.960848659539009e-09 1.747179226995219e-09 ] [ -1.632246285066912e-10 -5.328400488286283e-10 -2.151100453404364e-09 ] [ -3.630322367504946e-10 1.128527719173194e-09 -1.731225553162164e-10 ] [ 2.802521760574581e-09 5.365160989194442e-09 5.770439419430249e-10 ] [ 0.0 0.0 0.0 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5839387 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.946456110828336e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6582831 2.8687242 2.8616521 ] [ 1.4063187 2.1788427 1.0602834 ] [ 0.302104 6.1426348 3.6370701 ] [ 1.9251038 4.6104744 4.1720243 ] [ 4.6434203 1.8168569 3.3526571 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6582831e-10 2.8687242e-10 2.8616521e-10 ] [ 1.4063187e-10 2.1788427e-10 1.0602834e-10 ] [ 3.02104e-11 6.1426348e-10 3.6370701e-10 ] [ 1.9251038e-10 4.6104744e-10 4.1720243e-10 ] [ 4.6434203e-10 1.8168569e-10 3.3526571e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.8e-06 -1.6e-06 -3.1e-06 ] [ 2.1e-06 3.3e-06 4.3e-06 ] [ 3.7e-06 -5.3e-06 -1.4e-06 ] [ 1.4e-06 -5e-07 -4e-07 ] [ -3.3e-06 4.1e-06 6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.088271209199999e-15 -2.5634826144e-15 -4.9667475654e-15 ] [ 3.364570931399999e-15 5.2871828922e-15 6.8893595262e-15 ] [ 5.9280535458e-15 -8.4915361602e-15 -2.2430472876e-15 ] [ 2.2430472876e-15 -8.010883169999999e-16 -6.408706536e-16 ] [ -5.2871828922e-15 6.568924199399999e-15 9.613059803999998e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.575945 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.694453196146913e-18 } }