{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.561574e-11 1.0789901e-10 1.5696902e-10 ] [ -1.1329838e-10 2.0326274e-10 1.221844e-11 ] [ 1.7788923e-10 2.8485284e-10 2.6006726e-10 ] [ 2.4038234e-10 3.722621e-11 2.848197e-11 ] [ 3.7258273e-10 2.1435258e-10 1.3136249e-10 ] ] "source-value" [ [ 0.4561574 1.0789901 1.5696902 ] [ -1.1329838 2.0326274 0.1221844 ] [ 1.7788923 2.8485284 2.6006726 ] [ 2.4038234 0.3722621 0.2848197 ] [ 3.7258273 2.1435258 1.3136249 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.2914300788128e-12 1.78674736751616e-12 1.14411432491328e-12 ] [ -1.42145109797376e-12 -7.551058413830401e-13 -9.65311414032e-13 ] [ 1.32147527683584e-12 -1.4507709301344e-12 -2.22189853772544e-12 ] [ -8.520375269414401e-13 1.98301400356416e-12 -7.193773027392e-14 ] [ -3.33957694839552e-12 -1.56388459956288e-12 2.114873139456e-12 ] ] "source-value" [ [ 0.0026785 0.0011152 0.0007141 ] [ -0.0008872 -0.0004713 -0.0006025 ] [ 0.0008248 -0.0009055 -0.0013868 ] [ -0.0005318 0.0012377 -4.49e-05 ] [ -0.0020844 -0.0009761 0.00132 ] ] } "species" { "source-value" [ "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" -1.563527426328805e-18 "source-value" -9.7587707 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.040821781593433e-08 -2.996782192055686e-08 2.918500883778201e-08 ] [ -3.915808005254071e-08 2.151580031231565e-08 -2.90089959572682e-08 ] [ 3.83097989889044e-09 1.533190292122788e-08 2.547065586121415e-08 ] [ 1.71500061669544e-08 -3.552158324668399e-08 -1.654299063215553e-08 ] [ 4.858531180263021e-08 2.864170177347966e-08 -9.103678269790097e-09 ] ] "source-value" [ [ -18.9793169 -18.7044434 18.2158499 ] [ -24.4405514 13.4291064 -18.1059913 ] [ 2.3911096 9.5694212 15.8975331 ] [ 10.704192 -22.1708286 -10.3253227 ] [ 30.3245667 17.8767443 -5.6820691 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.45920861292146e-18 "source-value" 15.349173 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "instance-id" 1 }