{ "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" [ [ 0.7145242 0.8187554 1.873184 ] [ 0.3169354 2.259423 0.2511792 ] [ 1.412151 2.902885 2.703929 ] [ 2.136626 0.3772665 0.2243012 ] [ 2.65148 2.117604 0.8383983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.145242000000001e-11 8.187554e-11 1.873184e-10 ] [ 3.169354e-11 2.259423e-10 2.511792e-11 ] [ 1.412151e-10 2.902885e-10 2.703929e-10 ] [ 2.136626e-10 3.772665e-11 2.243012e-11 ] [ 2.65148e-10 2.117604e-10 8.383983000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5432319 -3.2627258 3.2785909 ] [ -4.8265245 2.347148 -3.6873412 ] [ 0.5594458 1.9359231 3.5404199 ] [ 1.6428725 -5.9372365 -2.5880931 ] [ 6.1674381 4.9168912 -0.5435765 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.676883312252764e-09 -5.227462996840976e-09 5.252881689147631e-09 ] [ -7.73294471361841e-09 3.760545651157478e-09 -5.907771863552617e-09 ] [ 8.963309813647526e-10 3.101690730486661e-09 5.672377991595074e-09 ] [ 2.632171910455248e-09 -9.51250151246042e-09 -4.146582257273797e-09 ] [ 9.881325134051173e-09 7.877728127657257e-09 -8.709055599162913e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7679033 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.084337643909517e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.337654 0.7621748 1.8726291 ] [ 0.0267826 2.3401411 0.1046036 ] [ 1.6484791 2.6268248 2.8090132 ] [ 2.2792593 0.1479592 0.4848973 ] [ 2.9395415 2.598834 0.6198484 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.37654e-11 7.621748e-11 1.8726291e-10 ] [ 2.67826e-12 2.3401411e-10 1.046036e-11 ] [ 1.6484791e-10 2.6268248e-10 2.8090132e-10 ] [ 2.2792593e-10 1.479592e-11 4.848973e-11 ] [ 2.9395415e-10 2.598834e-10 6.198484e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0013753 -0.0005133 -0.0004654 ] [ -0.0003362 -0.0001139 -6.2e-05 ] [ 2.37e-05 0.0006603 0.0022992 ] [ 0.000335 -0.0014804 -5.13e-05 ] [ 0.0013528 0.0014474 -0.0017206 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.20347350658624e-12 -8.2239725945664e-13 -7.456529993203199e-13 ] [ -5.386517799129599e-13 -1.8248791710912e-13 -9.93349504896e-14 ] [ 3.797158591296e-14 1.05791722271424e-12 3.68372448654336e-12 ] [ 5.36729167968e-13 -2.37186226943232e-12 -8.219166064704e-14 ] [ 2.16742453261824e-12 2.31899044094592e-12 -2.75670509374848e-12 ] ] } "relaxed-potential-energy" { "source-value" -12.809519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.052311186549339e-18 } }