{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1851386 -0.3485123 2.5336868 ] [ -3.4951282 -0.8477885 -2.7571361 ] [ 1.0524636 -2.5672063 -1.9362531 ] [ 1.3985896 -1.2791839 1.579313 ] [ -0.7420117 0.7550082 -0.4034882 ] [ 1.7356495 1.4237419 1.214876 ] [ 1.2355758 2.8639409 -0.2309984 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.898801372971472e-09 -5.583782637215982e-10 4.05941378883423e-09 ] [ -5.599812734874478e-09 -1.358306925273909e-09 -4.417419036177887e-09 ] [ 1.686232588055522e-09 -4.113117948517594e-09 -3.102219474330065e-09 ] [ 2.240787577675406e-09 -2.049478555168992e-09 2.530338386372442e-09 ] [ -1.188833807894618e-09 1.209656496518399e-09 -6.464593661347187e-10 ] [ 2.780817073713783e-09 2.281086005026765e-09 1.946445940407384e-09 ] [ 1.979610676295857e-09 4.588539191136929e-09 -3.701002389713856e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.373814 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.264244873626207e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3686047 2.2344067 1.1769657 ] [ 2.6288042 1.7671895 3.6109457 ] [ 1.2266514 4.1568832 2.1139297 ] [ 2.2605444 4.1316215 4.3067123 ] [ 4.6400172 1.9117826 2.1368952 ] [ 3.6777368 4.2314751 2.1533364 ] [ 4.5665663 3.2013945 4.2642909 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3686047e-10 2.2344067e-10 1.1769657e-10 ] [ 2.6288042e-10 1.7671895e-10 3.6109457e-10 ] [ 1.2266514e-10 4.156883200000001e-10 2.1139297e-10 ] [ 2.2605444e-10 4.1316215e-10 4.3067123e-10 ] [ 4.6400172e-10 1.9117826e-10 2.1368952e-10 ] [ 3.6777368e-10 4.2314751e-10 2.1533364e-10 ] [ 4.5665663e-10 3.2013945e-10 4.2642909e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.8e-06 2.35e-05 -6.4e-06 ] [ 5.8e-06 -5.2e-06 5.9e-06 ] [ 9.6e-06 -7.9e-06 -2.1e-06 ] [ 1.48e-05 3.11e-05 -2.52e-05 ] [ 7.6e-06 1.01e-05 -6e-07 ] [ -5.17e-05 -3.41e-05 2.57e-05 ] [ 6.1e-06 -1.76e-05 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.24969777452e-14 3.765115089899999e-14 -1.02539304576e-14 ] [ 9.2926244772e-15 -8.331318496799998e-15 9.452842140600001e-15 ] [ 1.53808956864e-14 -1.26571954086e-14 -3.364570931399999e-15 ] [ 2.37122141832e-14 4.982769331739999e-14 -4.037485117679999e-14 ] [ 1.21765424184e-14 1.61819840034e-14 -9.613059803999998e-16 ] [ -8.28325319778e-14 -5.46342232194e-14 4.11759394938e-14 ] [ 9.773277467399999e-15 -2.81983087584e-14 4.486094575199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.385491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.586551062081729e-18 } }