{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.371207 0.5985676 -1.2630441 ] [ -4.1624986 -1.199656 4.788448 ] [ -2.3307379 -1.7482908 0.3488213 ] [ 1.3107821 -0.1952839 -2.7912482 ] [ 6.650047 -3.7870347 -2.620384 ] [ 0.1110343 4.8407559 3.0091018 ] [ 1.7925801 1.4909419 -1.4716949 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.401269083777237e-09 9.590110225894583e-10 -2.023619744731559e-09 ] [ -6.669057995977712e-09 -1.922060812037904e-09 7.67193949872403e-09 ] [ -3.734253803358228e-09 -2.801070669197167e-09 5.588733363015041e-10 ] [ 2.100104452885451e-09 -3.128793015763926e-10 -4.472072645734559e-09 ] [ 1.06545499184018e-08 -6.067498508487199e-09 -4.198318016907455e-09 ] [ 1.778965610325462e-10 7.75574599387764e-09 4.82111259328734e-09 ] [ 2.872029950793383e-09 2.388752274831564e-09 -2.357915181156966e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.991913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.241751607356084e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.810721 2.6549145 2.7494759 ] [ 2.5630491 0.8357895 5.7981527 ] [ 1.9763944 0.1940518 3.4075635 ] [ 3.8178251 1.1901561 1.7699084 ] [ 4.5257517 0.5269255 4.131122 ] [ 3.5666966 2.9118779 4.6918171 ] [ 4.1666692 3.649687 2.3175533 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.810721e-10 2.6549145e-10 2.7494759e-10 ] [ 2.5630491e-10 8.357895e-11 5.7981527e-10 ] [ 1.9763944e-10 1.940518e-11 3.4075635e-10 ] [ 3.8178251e-10 1.1901561e-10 1.7699084e-10 ] [ 4.5257517e-10 5.269255000000001e-11 4.131122000000001e-10 ] [ 3.566696600000001e-10 2.9118779e-10 4.6918171e-10 ] [ 4.166669200000001e-10 3.649687e-10 2.3175533e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.79e-05 1.27e-05 -9e-07 ] [ -3.9e-06 -3e-06 1.48e-05 ] [ 3.7e-06 4.8e-06 7.3e-06 ] [ 1.25e-05 -9.3e-06 -8.6e-06 ] [ -4e-06 -1.28e-05 -2.4e-06 ] [ 1e-06 3.3e-06 -3.67e-05 ] [ -2.73e-05 4.4e-06 2.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.86789617486e-14 2.03476432518e-14 -1.4419589706e-15 ] [ -6.248488872599999e-15 -4.806529901999999e-15 2.37122141832e-14 ] [ 5.9280535458e-15 7.690447843199998e-15 1.16958894282e-14 ] [ 2.0027207925e-14 -1.49002426962e-14 -1.37787190524e-14 ] [ -6.408706535999999e-15 -2.05078609152e-14 -3.845223921599999e-15 ] [ 1.602176634e-15 5.2871828922e-15 -5.879988246779999e-14 ] [ -4.37394221082e-14 7.0495771896e-15 4.2457680801e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.515581 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.646087797513435e-18 } }