{ "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" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.5139498 -8.3011079 0.459183 ] [ -6.6456285 6.6102892 -8.6608802 ] [ -3.078049 7.8151961 13.1093769 ] [ 3.5375317 -4.9329968 -12.4055079 ] [ 12.9083653 -8.0616192 10.6590103 ] [ 6.7917302 6.8702386 -3.1611821 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.165173442422484e-08 -1.329984100411819e-08 7.356922672688064e-10 ] [ -1.064747061322217e-08 1.059085081296674e-08 -1.387625977198963e-08 ] [ -4.93157814547682e-09 1.252132447838734e-08 2.100353718243558e-08 ] [ 5.66775058507888e-09 -7.903532143441214e-09 -1.98758147265297e-08 ] [ 2.068148109640598e-08 -1.29161378080324e-08 1.707761710352639e-08 ] [ 1.088155134122131e-08 1.100733566423772e-08 -5.064772054711447e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.392411 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.230888350744749e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.6572412 1.5729327 1.7281967 ] [ 0.2141316 2.8854756 -0.1184261 ] [ 1.04368 1.5150194 3.4231913 ] [ 3.5301917 0.864277 0.0477476 ] [ 3.0377963 0.5753424 2.4070145 ] [ 2.587224 2.9694809 -0.6218906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.572412e-11 1.5729327e-10 1.7281967e-10 ] [ 2.141316e-11 2.8854756e-10 -1.184261e-11 ] [ 1.04368e-10 1.5150194e-10 3.4231913e-10 ] [ 3.5301917e-10 8.64277e-11 4.774760000000001e-12 ] [ 3.0377963e-10 5.753424000000001e-11 2.4070145e-10 ] [ 2.587224e-10 2.9694809e-10 -6.218906e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.01e-05 -4.56e-05 1.15e-05 ] [ 5e-07 4.16e-05 -2.57e-05 ] [ 2.17e-05 1.99e-05 -4.9e-06 ] [ 1.1e-05 -2.1e-05 -3.19e-05 ] [ -8.3e-06 -1.2e-05 4.87e-05 ] [ -4.9e-06 1.71e-05 2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.220375007808e-14 -7.305925390848e-14 1.84250311392e-14 ] [ 8.010883104e-16 6.665054742528e-14 -4.117593915456e-14 ] [ 3.476723267136e-14 3.188331475392e-14 -7.850665441919999e-15 ] [ 1.76239428288e-14 -3.36457090368e-14 -5.110943420352001e-14 ] [ -1.329806595264e-14 -1.92261194496e-14 7.802600143296e-14 ] [ -7.850665441919999e-15 2.739722021568e-14 3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.316417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.774395847342368e-18 } }