{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6656163 -1.8438233 -3.1975964 ] [ 0.3862924 -0.0586515 -1.5071405 ] [ -2.6298726 -1.3098442 1.1638657 ] [ -0.7895714 0.5362065 0.1221482 ] [ 3.6183524 -1.6013051 1.6213541 ] [ 0.7384165 2.1346266 -0.1770414 ] [ 0.341999 2.142791 1.9744104 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.668611495083399e-09 -2.954130584146305e-09 -5.123114194834245e-09 ] [ 6.18908652072722e-10 -9.39700620748512e-11 -2.414705273360822e-09 ] [ -4.21352039540251e-09 -2.098601754130479e-09 1.864718414291027e-09 ] [ -1.265032837532325e-09 8.590975182209952e-10 1.957029903128025e-10 ] [ 5.797239621095571e-09 -2.565573593987806e-09 2.597695633058225e-09 ] [ 1.183073652712963e-09 3.420048832657793e-09 -2.836515919937011e-10 ] [ 5.479428021369793e-10 3.433129643460653e-09 3.163354182744376e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.262123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.246349975837396e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5352139 1.8336112 1.6110091 ] [ 1.5014879 3.0576158 4.6091651 ] [ 1.8054452 0.9236642 3.7433065 ] [ 1.088383 3.6226241 2.3942247 ] [ 4.0845523 1.3692814 3.4250231 ] [ 3.3671692 4.0694382 2.075295 ] [ 3.7951734 3.5064761 4.2879645 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5352139e-10 1.8336112e-10 1.6110091e-10 ] [ 1.5014879e-10 3.0576158e-10 4.609165100000001e-10 ] [ 1.8054452e-10 9.236642000000001e-11 3.7433065e-10 ] [ 1.088383e-10 3.6226241e-10 2.3942247e-10 ] [ 4.084552300000001e-10 1.3692814e-10 3.4250231e-10 ] [ 3.3671692e-10 4.069438199999999e-10 2.075295e-10 ] [ 3.7951734e-10 3.5064761e-10 4.2879645e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-05 -1.83e-05 -2.69e-05 ] [ -3.37e-05 3.7e-05 2.81e-05 ] [ -2.77e-05 -7.56e-05 4.02e-05 ] [ -6.02e-05 4.45e-05 -5.41e-05 ] [ 7.6e-05 -6.8e-06 -4.31e-05 ] [ 3.59e-05 1.5e-06 1.08e-05 ] [ 2.66e-05 1.77e-05 4.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72370025536e-14 -2.931983216064e-14 -4.309855109952001e-14 ] [ -5.399335212096e-14 5.92805349696e-14 4.502116304448e-14 ] [ -4.438029239616e-14 -1.2112455253248e-13 6.440750015616e-14 ] [ -9.645103257216e-14 7.129685962560001e-14 -8.667775518528e-14 ] [ 1.217654231808e-13 -1.089480102144e-14 -6.905381235648e-14 ] [ 5.751814068672e-14 2.4032649312e-15 1.730350750464e-14 ] [ 4.261789811328e-14 2.835852618816e-14 7.193773027392e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993258982137e-18 } }