{ "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" [ [ 2.164327 2.183765 1.328393 ] [ 2.70587 2.068279 5.162644 ] [ 0.8559813 1.907046 3.441903 ] [ 2.386273 0.2061938 3.516969 ] [ 3.489815 3.035472 2.979319 ] [ 4.556806 1.225964 3.894732 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.164327e-10 2.183765e-10 1.328393e-10 ] [ 2.70587e-10 2.068279e-10 5.162644000000001e-10 ] [ 8.559813e-11 1.907046e-10 3.441903e-10 ] [ 2.386273e-10 2.061938e-11 3.516969e-10 ] [ 3.489815e-10 3.035472e-10 2.979319e-10 ] [ 4.556806e-10 1.225964e-10 3.894732e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4695061 0.573082 -1.3056281 ] [ -0.7291312 1.4417496 2.9620109 ] [ -2.8760179 -0.2095515 0.1558309 ] [ -1.0726343 -5.9827515 0.0603965 ] [ 3.4697514 5.0345995 -1.7603974 ] [ 1.677538 -0.857128 -0.1122128 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.522316967429868e-10 9.181785822013056e-10 -2.091846817279525e-09 ] [ -1.168196962135849e-09 2.309937502167752e-09 4.745664614534767e-09 ] [ -4.607888640382312e-09 -3.357385141535712e-10 2.496686247782227e-10 ] [ -1.718549598128174e-09 -9.585424581356132e-09 9.676586027814719e-11 ] [ 5.559154573068069e-09 8.06631761399137e-09 -2.820467557597106e-09 ] [ 2.68771216410359e-09 -1.373270442633062e-09 -1.797847247145062e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.943816 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.073827937913697e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8467869 2.893115 1.7471857 ] [ 2.2934235 2.3155585 5.3577476 ] [ 0.9809053 1.495846 3.4567712 ] [ 2.6356605 -0.3110549 3.3843504 ] [ 4.1874167 2.8277151 2.2400796 ] [ 4.2148794 1.40554 4.1378256 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8467869e-10 2.893115e-10 1.7471857e-10 ] [ 2.2934235e-10 2.3155585e-10 5.3577476e-10 ] [ 9.809053e-11 1.495846e-10 3.4567712e-10 ] [ 2.6356605e-10 -3.110549e-11 3.384350400000001e-10 ] [ 4.1874167e-10 2.8277151e-10 2.2400796e-10 ] [ 4.2148794e-10 1.40554e-10 4.1378256e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.4e-06 -3.39e-05 7.1e-06 ] [ 5e-06 -1.87e-05 8.1e-06 ] [ 4.04e-05 2.21e-05 -3.8e-05 ] [ -1.4e-05 2.71e-05 3.91e-05 ] [ -2.75e-05 2.76e-05 1.61e-05 ] [ -9.3e-06 -2.42e-05 -3.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.65175375232e-15 -5.431378744512e-14 1.137545400768e-14 ] [ 8.010883104e-15 -2.996070280896e-14 1.297763062848e-14 ] [ 6.472793548032e-14 3.540810331968e-14 -6.08827115904e-14 ] [ -2.24304726912e-14 4.341898642368e-14 6.264510587328001e-14 ] [ -4.4059857072e-14 4.422007473408001e-14 2.579504359488e-14 ] [ -1.490024257344e-14 -3.877267422336e-14 -5.191052251392001e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }