{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3244638 3.3663653 8.5254563 ] [ 3.5118969 3.710416 -4.2991328 ] [ 8.1939656 -0.9668412 -2.5437542 ] [ -4.3258807 0.0938637 -1.2136442 ] [ -7.0555179 -6.2038037 -0.468925 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.198483146559272e-10 5.393511780732379e-09 1.365928676551207e-08 ] [ 5.626679107839995e-09 5.944741768642253e-09 -6.887970061874442e-09 ] [ 1.312818011595945e-08 -1.549050366666217e-09 -4.075543508301808e-09 ] [ -6.930824921909938e-09 1.50386225681785e-10 -1.94447236320952e-09 ] [ -1.130418582701591e-08 -9.939589248172539e-09 -7.5130067190864e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.626405 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.304714386215222e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8136276 2.7157242 1.1388756 ] [ 1.2153486 1.702764 3.0160503 ] [ 0.7802699 3.8576589 2.7422852 ] [ 2.4298741 4.7936384 1.5974874 ] [ 2.8739364 3.1712205 3.0391465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8136276e-10 2.7157242e-10 1.1388756e-10 ] [ 1.2153486e-10 1.702764e-10 3.0160503e-10 ] [ 7.802699e-11 3.8576589e-10 2.7422852e-10 ] [ 2.4298741e-10 4.7936384e-10 1.5974874e-10 ] [ 2.8739364e-10 3.1712205e-10 3.0391465e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.71e-05 7.8e-06 -1.37e-05 ] [ -2.9e-05 -4.86e-05 2.93e-05 ] [ 2.53e-05 -1.42e-05 -1.93e-05 ] [ 9.3e-06 4.3e-05 -1.33e-05 ] [ 1.15e-05 1.19e-05 1.7e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.739722021568e-14 1.249697764224e-14 -2.194981970496e-14 ] [ -4.64631220032e-14 -7.786578377088e-14 4.694377498944e-14 ] [ 4.053506850624e-14 -2.275090801536e-14 -3.092200878144e-14 ] [ 1.490024257344e-14 6.889359469439999e-14 -2.130894905664e-14 ] [ 1.84250311392e-14 1.906590178752e-14 2.72370025536e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }