{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5100398 -2.5053984 0.7898831 ] [ -0.3996758 1.521949 -1.1884079 ] [ -2.6921083 2.7029359 4.4833122 ] [ 7.4733872 -9.2704799 -19.2467321 ] [ 2.8405169 -2.7768303 27.477809 ] [ -1.7120802 10.3278238 -12.3158642 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.828057019970034e-09 -4.014090775340985e-09 1.265532246411485e-09 ] [ -6.403512279352571e-10 2.438431125939666e-09 -1.904039369041008e-09 ] [ -4.313233014457462e-09 4.33058074217976e-09 7.183058049767135e-09 ] [ 1.197368634867468e-08 -1.485294628174666e-08 -3.083666445147774e-08 ] [ 4.551009805662114e-09 -4.44897262324321e-09 4.40243035333149e-08 ] [ -2.743054891974046e-09 1.654699797242909e-08 -1.97321898487571e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7590501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.420485602255364e-19 } "relaxed-configuration-positions" { "source-value" [ [ -1.1029576 0.9652861 1.9957955 ] [ 0.3232868 2.5306849 0.6718162 ] [ 0.8344296 2.0801022 3.1099284 ] [ 3.9228434 1.2862073 1.0014501 ] [ 3.0380228 1.338039 3.1390787 ] [ 2.2825203 2.0039983 -0.4645526 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.1029576e-10 9.652861000000001e-11 1.9957955e-10 ] [ 3.232868e-11 2.5306849e-10 6.718162e-11 ] [ 8.344296e-11 2.0801022e-10 3.1099284e-10 ] [ 3.9228434e-10 1.2862073e-10 1.0014501e-10 ] [ 3.0380228e-10 1.338039e-10 3.1390787e-10 ] [ 2.2825203e-10 2.0039983e-10 -4.645526e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.6e-06 -4.1e-06 4.6e-06 ] [ -6.6e-06 1e-06 -6.2e-06 ] [ 2.2e-06 6.8e-06 -2.6e-06 ] [ 1.8e-06 6e-07 4.6e-06 ] [ 2.2e-06 -5.6e-06 -1.13e-05 ] [ 5e-06 1.3e-06 1.1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.370012516399999e-15 -6.568924199399999e-15 7.370012516399999e-15 ] [ -1.05743657844e-14 1.602176634e-15 -9.9334951308e-15 ] [ 3.5247885948e-15 1.08948011112e-14 -4.165659248399999e-15 ] [ 2.8839179412e-15 9.613059803999998e-16 7.370012516399999e-15 ] [ 3.5247885948e-15 -8.972189150399999e-15 -1.81045959642e-14 ] [ 8.010883169999999e-15 2.0828296242e-15 1.7623942974e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.74192 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.361915976429728e-18 } }