{ "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" [ [ 0.7607129 0.1029019 2.480933 ] [ 0.9158836 2.552597 0.2381701 ] [ 0.8989231 2.268448 2.632769 ] [ 2.109562 0.2713555 0.0459784 ] [ 2.969591 1.985029 0.1686784 ] [ 2.973458 2.362165 2.304699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.607129000000001e-11 1.029019e-11 2.480933e-10 ] [ 9.158836e-11 2.552597e-10 2.381701e-11 ] [ 8.989231e-11 2.268448e-10 2.632769e-10 ] [ 2.109562e-10 2.713555e-11 4.59784e-12 ] [ 2.969591e-10 1.985029e-10 1.686784e-11 ] [ 2.973458e-10 2.362165e-10 2.304699e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7063908 -1.668114 -2.9169479 ] [ -0.0615841 -2.2838389 3.4213909 ] [ -4.2904614 2.0726487 -0.1818274 ] [ -9.6704874 -10.0521603 1.9942585 ] [ 10.6681178 11.2560014 -1.7989928 ] [ 1.6480244 0.6754632 -0.5178812 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.733939468232567e-09 -2.672613273648276e-09 -4.673465767975368e-09 ] [ -9.86686060459194e-11 -3.659113321400263e-09 5.481672555760231e-09 ] [ -6.874077004158927e-09 3.320749317630475e-09 -2.913196117009716e-10 ] [ -1.549382895167141e-08 -1.610533635388243e-08 3.195154370855889e-09 ] [ 1.709220906791948e-08 1.803410243535129e-08 -2.882304228894235e-09 ] [ 2.640426185941869e-09 1.082211356166869e-09 -8.297371578278807e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.488096 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.801901878434886e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1070783 0.405538 2.1753319 ] [ 0.9587948 2.1975249 0.5712014 ] [ 0.5581828 2.6036131 2.8766066 ] [ 2.0056668 0.1512066 0.0249656 ] [ 3.2480502 2.1287304 -0.0285279 ] [ 2.7503578 2.0558834 2.2516502 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1070783e-10 4.05538e-11 2.1753319e-10 ] [ 9.587947999999999e-11 2.1975249e-10 5.712014e-11 ] [ 5.581828e-11 2.6036131e-10 2.8766066e-10 ] [ 2.0056668e-10 1.512066e-11 2.49656e-12 ] [ 3.2480502e-10 2.1287304e-10 -2.85279e-12 ] [ 2.7503578e-10 2.0558834e-10 2.2516502e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.99e-05 9.17e-05 -1.83e-05 ] [ 0.0001302 -3.79e-05 -1.58e-05 ] [ -4.9e-05 -5.57e-05 7.43e-05 ] [ -4.18e-05 2.69e-05 1.99e-05 ] [ -2.63e-05 -3.15e-05 4e-05 ] [ -5.31e-05 6.4e-06 -0.0001001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.392684769659999e-14 1.469195973378e-13 -2.93198324022e-14 ] [ 2.086033977468e-13 -6.072249442859999e-14 -2.53143908172e-14 ] [ -7.850665506599998e-14 -8.924123851379999e-14 1.190417239062e-13 ] [ -6.697098330119999e-14 4.309855145459999e-14 3.18833150166e-14 ] [ -4.21372454742e-14 -5.046856397099999e-14 6.408706535999999e-14 ] [ -8.507557926539999e-14 1.02539304576e-14 -1.603778810634e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.45441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.918028430025594e-18 } }