{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -34.1033811 29.3139757 -48.1440688 ] [ 5.5633757 -16.4684175 60.3584596 ] [ 26.2497596 -13.3800374 -11.1176101 ] [ -46.2837272 44.7629275 -50.1125814 ] [ 48.5739729 -44.2284483 49.0158007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.463963988865259e-08 4.696616652923932e-08 -7.713530146154672e-08 ] [ 8.913510479266834e-09 -2.638531350007359e-08 9.670491283862132e-08 ] [ 4.205675113274036e-08 -2.143718310770962e-08 -1.781237498138995e-08 ] [ -7.415470564332505e-08 7.17181159190654e-08 -8.028920632701695e-08 ] [ 7.782408375975279e-08 -7.08617858405215e-08 7.853196993133228e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 30.876888 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.947022807666007e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0850627 0.953054 0.9455872 ] [ 0.4129361 0.4373965 3.1880222 ] [ 1.9734055 -0.0610658 0.4351293 ] [ 1.495639 2.6783907 1.17116 ] [ 2.5687922 1.0147089 2.438753 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.50627e-12 9.53054e-11 9.455872e-11 ] [ 4.129361e-11 4.373965e-11 3.1880222e-10 ] [ 1.9734055e-10 -6.10658e-12 4.351293e-11 ] [ 1.495639e-10 2.6783907e-10 1.17116e-10 ] [ 2.5687922e-10 1.0147089e-10 2.438753e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.96e-05 -2.18e-05 1.44e-05 ] [ -2.34e-05 4.7e-06 1.15e-05 ] [ -1.23e-05 3.3e-06 -2.64e-05 ] [ 2.2e-06 1.58e-05 -6.9e-06 ] [ 3.9e-06 -2.1e-06 7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.742442797568e-14 -3.492745033344e-14 2.307134333952e-14 ] [ -3.749093292672001e-14 7.53023011776e-15 1.84250311392e-14 ] [ -1.970677243584e-14 5.28718284864e-15 -4.229746278912e-14 ] [ 3.52478856576e-15 2.531439060864e-14 -1.105501868352e-14 ] [ 6.24848882112e-15 -3.36457090368e-15 1.185610699392e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.191316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273699471358497e-18 } }