{ "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" [ [ 2.38521 1.90546 0.8111876 ] [ 1.820048 1.934055 3.373724 ] [ 3.762919 1.896883 2.504871 ] [ 3.3319 2.668439 4.803022 ] [ 3.103403 4.016922 2.717172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.38521e-10 1.90546e-10 8.111876000000001e-11 ] [ 1.820048e-10 1.934055e-10 3.373724e-10 ] [ 3.762919e-10 1.896883e-10 2.504871e-10 ] [ 3.3319e-10 2.668439e-10 4.803022000000001e-10 ] [ 3.103403e-10 4.016922e-10 2.717172e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7437982 -1.8338166 -7.7276885 ] [ -14.0542955 -6.1370252 4.1477881 ] [ 12.3997054 -6.9202708 -5.2636995 ] [ 2.832157 1.4472508 11.036698 ] [ 1.5662313 13.4438618 -2.1930982 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.396049328233123e-09 -2.938098083354945e-09 -1.238112184752502e-08 ] [ -2.251746367191465e-08 -9.832598296700445e-09 6.645489121852452e-09 ] [ 1.986651809668751e-08 -1.108749608536491e-08 -8.433376277816651e-09 ] [ 4.537615731835066e-09 2.318751396194096e-09 1.768273950643012e-08 ] [ 2.509379171625192e-09 2.153944106922621e-08 -3.513730663158563e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.6528861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.648215466265291e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4033561 2.2799288 1.2812466 ] [ 1.298893 1.6615202 3.4335458 ] [ 4.4114266 1.4472902 2.5096594 ] [ 3.3580377 2.6887567 4.402746 ] [ 2.9317666 4.3442632 2.5827789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4033561e-10 2.2799288e-10 1.2812466e-10 ] [ 1.298893e-10 1.6615202e-10 3.4335458e-10 ] [ 4.411426600000001e-10 1.4472902e-10 2.5096594e-10 ] [ 3.3580377e-10 2.6887567e-10 4.402746e-10 ] [ 2.9317666e-10 4.344263200000001e-10 2.5827789e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.1e-06 2.3e-05 4.18e-05 ] [ 3.48e-05 -7.9e-06 -2.33e-05 ] [ -1.83e-05 -1.42e-05 1.57e-05 ] [ -9.9e-06 2.09e-05 -4.33e-05 ] [ -5e-07 -2.18e-05 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.77327738688e-15 3.68500622784e-14 6.697098274944e-14 ] [ 5.575574640383999e-14 -1.265719530432e-14 -3.733071526464e-14 ] [ -2.931983216064e-14 -2.275090801536e-14 2.515417294656e-14 ] [ -1.586154854592e-14 3.348549137472e-14 -6.937424768064e-14 ] [ -8.010883104e-16 -3.492745033344e-14 1.457980724928e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }