{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.304566 2.573407 2.013286 ] [ 1.594988 1.205897 3.788304 ] [ 4.305804 2.27362 1.126873 ] [ 3.775257 0.6680547 2.70197 ] [ 5.174566 3.086819 3.056932 ] [ 3.543793 4.723705 1.740813 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.304566e-10 2.573407e-10 2.013286e-10 ] [ 1.594988e-10 1.205897e-10 3.788304e-10 ] [ 4.305804000000001e-10 2.27362e-10 1.126873e-10 ] [ 3.775257e-10 6.680547000000001e-11 2.70197e-10 ] [ 5.174566e-10 3.086819000000001e-10 3.056932e-10 ] [ 3.543793e-10 4.723705e-10 1.740813e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.0149991 2.2695337 0.4764344 ] [ -0.49971 -0.7015875 0.923422 ] [ 4.1335162 -0.9178489 -6.8391589 ] [ 0.2997462 -2.7433649 2.0215988 ] [ 2.1091776 1.640891 3.0646762 ] [ -0.0277309 0.4523765 0.3530275 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.637090932153041e-09 3.636193834257721e-09 7.633320570248755e-10 ] [ -8.00623679179968e-10 -1.12406708994552e-09 1.479485139532378e-09 ] [ 6.622623017338057e-09 -1.470556049006997e-09 -1.095754049551624e-08 ] [ 4.80246353813641e-10 -4.39535510510333e-09 3.238958333997335e-09 ] [ 3.379275039835054e-09 2.628997197481133e-09 4.910152557962185e-09 ] [ -4.442979965374272e-11 7.247870520993313e-10 5.65612406999472e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.758199 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.723653491971394e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7430664 2.9053075 1.7782792 ] [ 1.7631721 1.1314888 3.368577 ] [ 4.0254123 2.1035224 0.9902036 ] [ 4.12461 0.8601847 3.207704 ] [ 5.3867724 3.0223201 3.0611744 ] [ 3.6559408 4.5086793 2.0222398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7430664e-10 2.9053075e-10 1.7782792e-10 ] [ 1.7631721e-10 1.1314888e-10 3.368577e-10 ] [ 4.0254123e-10 2.1035224e-10 9.902036e-11 ] [ 4.12461e-10 8.601847e-11 3.207704e-10 ] [ 5.386772400000001e-10 3.0223201e-10 3.0611744e-10 ] [ 3.655940800000001e-10 4.5086793e-10 2.0222398e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.17e-05 8.5e-06 3.46e-05 ] [ 3.34e-05 1.64e-05 -5.8e-05 ] [ -5.3e-06 -3.24e-05 9.6e-06 ] [ -3.64e-05 2.77e-05 9.7e-06 ] [ 2.75e-05 1.11e-05 -1.08e-05 ] [ -3.1e-05 -3.13e-05 1.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.874546646336e-14 1.36185012768e-14 5.543531107968001e-14 ] [ 5.351269913472e-14 2.627569658112e-14 -9.29262440064e-14 ] [ -8.491536090240001e-15 -5.191052251392001e-14 1.538089555968e-14 ] [ -5.831922899712e-14 4.438029239616e-14 1.554111322176e-14 ] [ 4.4059857072e-14 1.778416049088e-14 -1.730350750464e-14 ] [ -4.96674752448e-14 -5.014812823104e-14 2.387243164992e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.180008 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.271887730035697e-18 } }