{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0580656 -1.7762909 -0.8980693 ] [ -1.8937663 -0.3557583 9.3619523 ] [ -5.259559 3.3299171 -3.585237 ] [ 0.2748645 -8.8341375 -3.7238048 ] [ 2.7270896 -0.6724366 -5.1517266 ] [ -1.6979493 6.5653417 1.2385279 ] [ 8.9073861 1.7433644 2.7583573 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.899561209192724e-09 -2.845931751719791e-09 -1.438865636318221e-09 ] [ -3.034148091118919e-09 -5.699876309155527e-10 1.499950110010479e-08 ] [ -8.426742465518227e-09 5.335115326822135e-09 -5.744182901427129e-09 ] [ 4.403814757878816e-10 -1.415384856743256e-08 -5.96619299098282e-09 ] [ 4.369279199946823e-09 -1.077362199490241e-09 -8.253975915273473e-09 ] [ -2.720414671763726e-09 1.051883697930333e-08 1.98434044558852e-09 ] [ 1.427120576185889e-08 2.79317768321502e-09 4.419375577873012e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.756182 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.844853967506979e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8033105 2.4307424 1.6943352 ] [ 2.4933585 2.5898874 4.9646862 ] [ 1.3271942 3.9546811 3.4324843 ] [ 3.4362277 1.3686398 3.1133201 ] [ 4.0538373 3.2876255 1.6000663 ] [ 3.31326 5.1373172 2.9558732 ] [ 4.5736438 3.4075125 4.0636517 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8033105e-10 2.4307424e-10 1.6943352e-10 ] [ 2.4933585e-10 2.5898874e-10 4.9646862e-10 ] [ 1.3271942e-10 3.9546811e-10 3.4324843e-10 ] [ 3.4362277e-10 1.3686398e-10 3.1133201e-10 ] [ 4.0538373e-10 3.2876255e-10 1.6000663e-10 ] [ 3.31326e-10 5.137317200000001e-10 2.9558732e-10 ] [ 4.5736438e-10 3.4075125e-10 4.063651700000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 3.13e-05 -2.96e-05 ] [ -5.13e-05 1.92e-05 4.14e-05 ] [ 3.75e-05 -4.65e-05 1.4e-06 ] [ -1.34e-05 8.4e-06 -7.8e-06 ] [ -1.87e-05 7.1e-06 9.8e-06 ] [ -4.28e-05 -5.4e-06 -3.33e-05 ] [ 8.9e-05 -1.4e-05 1.8e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-16 5.014812823104e-14 -4.742442797568e-14 ] [ -8.219166064704e-14 3.076179111936e-14 6.633011210111999e-14 ] [ 6.008162327999999e-14 -7.45012128672e-14 2.24304726912e-15 ] [ -2.146916671872e-14 1.345828361472e-14 -1.249697764224e-14 ] [ -2.996070280896e-14 1.137545400768e-14 1.570133088384e-14 ] [ -6.857315937023999e-14 -8.65175375232e-15 -5.335248147264001e-14 ] [ 1.425937192512e-13 -2.24304726912e-14 2.88391791744e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.450209 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.596919999187375e-18 } }