{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.7112358 -6.8805332 -5.1504927 ] [ -9.5598541 -0.0149071 -18.0656705 ] [ -10.4730946 -3.5237787 12.931576 ] [ 12.2776673 0.092676 -2.4889422 ] [ 4.6761763 -3.0295818 5.8959892 ] [ 2.498358 -0.5310094 -3.030498 ] [ 14.2919829 13.8871343 9.9080381 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.196782144103598e-08 -1.102382943167821e-08 -8.251998989541069e-09 ] [ -1.531657473727903e-08 -2.388380710392768e-11 -2.894439491417625e-08 ] [ -1.677974731554673e-08 -5.645715850013017e-09 2.071866873729838e-08 ] [ 1.967099150602066e-08 1.484833205092608e-10 -3.987725003362517e-09 ] [ 7.492060342599047e-09 -4.853925130761181e-09 9.446416052729296e-09 ] [ 4.002810777988647e-09 -8.507708461050354e-10 -4.855393044981158e-09 ] [ 2.289828086725338e-08 2.224964190536977e-08 1.587442700181565e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.6407323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.037449415251412e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0642193 1.0723348 1.9680831 ] [ 1.5242799 3.5051476 2.4011978 ] [ 1.3788009 3.2561207 4.8776376 ] [ 4.2996116 1.8408073 2.8691122 ] [ 3.8124681 2.7636853 5.1027684 ] [ 3.8877425 4.1589336 2.1465773 ] [ 4.5686507 5.0741567 4.4044736 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0642193e-10 1.0723348e-10 1.9680831e-10 ] [ 1.5242799e-10 3.5051476e-10 2.4011978e-10 ] [ 1.3788009e-10 3.2561207e-10 4.8776376e-10 ] [ 4.299611600000001e-10 1.8408073e-10 2.8691122e-10 ] [ 3.8124681e-10 2.7636853e-10 5.102768400000001e-10 ] [ 3.8877425e-10 4.1589336e-10 2.1465773e-10 ] [ 4.5686507e-10 5.074156699999999e-10 4.4044736e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.9e-06 -7.9e-06 5.5e-06 ] [ -2.71e-05 -1.48e-05 -2.6e-06 ] [ 1.62e-05 1.48e-05 -3.21e-05 ] [ 1.7e-06 1.28e-05 -5.6e-06 ] [ 5.4e-06 3e-07 -1e-06 ] [ -2.1e-06 2e-06 3.12e-05 ] [ 9.9e-06 -7.1e-06 4.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.24848882112e-15 -1.265719530432e-14 8.8119714144e-15 ] [ -4.341898642368e-14 -2.371221398784e-14 -4.16565921408e-15 ] [ 2.595526125696e-14 2.371221398784e-14 -5.142986952768e-14 ] [ 2.72370025536e-15 2.050786074624e-14 -8.972189076479999e-15 ] [ 8.65175375232e-15 4.8065298624e-16 -1.6021766208e-15 ] [ -3.36457090368e-15 3.2043532416e-15 4.998791056896e-14 ] [ 1.586154854592e-14 -1.137545400768e-14 7.2097947936e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735010429801e-18 } }