{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -84.8869799 -40.1085621 7.1778845 ] [ -19.268365 23.6559144 -8.4713677 ] [ 33.4136482 -24.4420241 -15.5431446 ] [ 24.7182829 13.9157668 -7.9853847 ] [ 46.0234138 26.9789051 24.8220125 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.360039346060995e-07 -6.426100049052495e-08 1.15002387327027e-08 ] [ -3.087132392404099e-08 3.790095299532606e-08 -1.357262727514027e-08 ] [ 5.3534565961676e-08 -3.916043957805016e-08 -2.490286289183377e-08 ] [ 3.960305496870043e-08 2.229551622746483e-08 -1.279399667443402e-08 ] [ 7.373763759976409e-08 4.322497100600188e-08 3.976924810870537e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.698392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.995812650895375e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8333214 2.3964047 3.3554381 ] [ 2.5588502 4.5756496 1.6144101 ] [ 4.8261155 2.7866554 1.001906 ] [ 4.6349256 1.8952828 3.8099431 ] [ 4.7797702 4.8319026 3.5426237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8333214e-10 2.3964047e-10 3.3554381e-10 ] [ 2.5588502e-10 4.5756496e-10 1.6144101e-10 ] [ 4.8261155e-10 2.7866554e-10 1.001906e-10 ] [ 4.6349256e-10 1.8952828e-10 3.8099431e-10 ] [ 4.7797702e-10 4.831902600000001e-10 3.5426237e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 -4e-07 1.8e-06 ] [ -2.4e-05 1.45e-05 -1.01e-05 ] [ 1.1e-05 1.14e-05 2.67e-05 ] [ 2.2e-06 1.9e-06 -0.0 ] [ 7.5e-06 -2.74e-05 -1.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 -6.408706483200001e-16 2.88391791744e-15 ] [ -3.84522388992e-14 2.32315610016e-14 -1.618198387008e-14 ] [ 1.76239428288e-14 1.826481347712e-14 4.277811577536e-14 ] [ 3.52478856576e-15 3.04413557952e-15 0.0 ] [ 1.2016324656e-14 -4.389963940992e-14 -2.931983216064e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }