{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.159359e-10 1.972133e-10 2.4315513e-10 ] [ 2.7916884e-10 2.1575003e-10 4.7435066e-10 ] [ 4.3878021e-10 1.4901861e-10 1.8635377e-10 ] [ 5.0209388e-10 1.6796174e-10 4.1752361e-10 ] [ 5.0735503e-10 3.6165819e-10 2.751945e-10 ] [ 2.8455274e-10 4.0965043e-10 3.3230983e-10 ] ] "source-value" [ [ 2.159359 1.972133 2.4315513 ] [ 2.7916884 2.1575003 4.7435066 ] [ 4.3878021 1.4901861 1.8635377 ] [ 5.0209388 1.6796174 4.1752361 ] [ 5.0735503 3.6165819 2.751945 ] [ 2.8455274 4.0965043 3.3230983 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.04309562684416e-12 -5.02378501218048e-12 3.012092047104e-13 ] [ -1.62268448154624e-12 2.9736398082048e-12 5.9865329436192e-12 ] [ 4.10253345522048e-12 3.489540680102399e-12 -1.46567117270784e-12 ] [ -4.62035693906304e-12 -1.6214027402496e-13 -6.05126087909952e-12 ] [ 5.860762078886399e-13 -4.181680980288e-12 7.0351575419328e-13 ] [ -4.88663869344e-13 2.90442577818624e-12 5.2567414928448e-13 ] ] "source-value" [ [ 0.0012752 -0.0031356 0.000188 ] [ -0.0010128 0.001856 0.0037365 ] [ 0.0025606 0.002178 -0.0009148 ] [ -0.0028838 -0.0001012 -0.0037769 ] [ 0.0003658 -0.00261 0.0004391 ] [ -0.000305 0.0018128 0.0003281 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.014812863441442e-18 "source-value" -18.816982 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.883151776748655e-09 -6.477713832434476e-10 -1.664188866908064e-10 ] [ -3.853445619467297e-09 -7.993419378833281e-10 6.65940386558644e-10 ] [ 7.277010909372422e-10 -1.773359579672755e-09 -1.646908430746764e-09 ] [ 5.782141669927123e-09 -1.926237510435208e-09 3.849591423388301e-10 ] [ -1.692616286690918e-10 -1.902707624146815e-09 -8.483453109188064e-10 ] [ -4.370287129258969e-09 7.049418035381555e-09 1.610773099458902e-09 ] ] "source-value" [ [ 1.1753709 -0.4043071 -0.1038705 ] [ -2.4051316 -0.49891 0.4156473 ] [ 0.4541953 -1.106844 -1.0279194 ] [ 3.608929 -1.2022629 0.2402726 ] [ -0.1056448 -1.1875767 -0.5294955 ] [ -2.7277187 4.3999007 1.0053655 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.634216768476375e-18 "source-value" -16.441488 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.91701e-10 1.98827e-10 2.508844e-10 ] [ 2.572173e-10 1.794465e-10 4.860558000000001e-10 ] [ 4.363165000000001e-10 1.510923e-10 1.91691e-10 ] [ 4.651171e-10 2.095892e-10 4.214607e-10 ] [ 5.448722e-10 3.893309e-10 2.444809e-10 ] [ 3.326625e-10 3.729664e-10 3.343147e-10 ] ] "source-value" [ [ 1.91701 1.98827 2.508844 ] [ 2.572173 1.794465 4.860558 ] [ 4.363165 1.510923 1.91691 ] [ 4.651171 2.095892 4.214607 ] [ 5.448722 3.893309 2.444809 ] [ 3.326625 3.729664 3.343147 ] ] } "instance-id" 1 }