{ "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" [ [ 0.7955699 1.924478 0.0578634 ] [ 0.2789322 2.342777 2.34838 ] [ 2.533834 0.6960937 0.5593318 ] [ 1.694509 0.4311754 2.932881 ] [ 2.816233 2.726519 1.407602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.955699e-11 1.924478e-10 5.786340000000001e-12 ] [ 2.789322e-11 2.342777e-10 2.34838e-10 ] [ 2.533834e-10 6.960937e-11 5.593318000000001e-11 ] [ 1.694509e-10 4.311754e-11 2.932881e-10 ] [ 2.816233e-10 2.726519e-10 1.407602e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.7550325 0.7012042 -6.4198705 ] [ -2.7631679 1.1718666 1.9191731 ] [ 3.100536 -6.7859049 0.8211538 ] [ 0.3151089 -3.1536205 0.7158348 ] [ 8.1025556 8.0664545 2.9637088 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.40271085014106e-08 1.123452984902663e-09 -1.02857665084059e-08 ] [ -4.427083045198848e-09 1.877537284685024e-09 3.074854297421345e-09 ] [ 4.967606332075823e-09 -1.087221827132611e-08 1.315633431280309e-09 ] [ 5.048601167454426e-10 -5.052657077603396e-09 1.146893790364063e-09 ] [ 1.298172525800585e-08 1.292388491912415e-08 4.748384989340178e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4287586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.510653671654655e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4310636 2.0969919 -0.013261 ] [ -0.5727068 1.6512974 2.3261925 ] [ 2.5104255 1.0266716 0.8211709 ] [ 1.6368622 0.5545755 3.0970522 ] [ 4.1134336 2.7915066 1.0749036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.310636e-11 2.0969919e-10 -1.3261e-12 ] [ -5.727068e-11 1.6512974e-10 2.3261925e-10 ] [ 2.5104255e-10 1.0266716e-10 8.211709000000001e-11 ] [ 1.6368622e-10 5.545755e-11 3.0970522e-10 ] [ 4.1134336e-10 2.7915066e-10 1.0749036e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.35e-05 7.3e-06 -3.1e-06 ] [ -1.97e-05 5.5e-06 -4.5e-06 ] [ 1.23e-05 -9.7e-06 1.11e-05 ] [ 1.96e-05 -1.5e-06 -4.7e-06 ] [ 1.4e-06 -1.6e-06 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.162938455899999e-14 1.16958894282e-14 -4.9667475654e-15 ] [ -3.15628796898e-14 8.811971486999999e-15 -7.209794853e-15 ] [ 1.97067725982e-14 -1.55411133498e-14 1.77841606374e-14 ] [ 3.140266202639999e-14 -2.403264951e-15 -7.530230179799999e-15 ] [ 2.2430472876e-15 -2.5634826144e-15 1.9226119608e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }