{ "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" [ [ 2.317023 1.146232 2.35214 ] [ 1.137751 1.512768 4.697187 ] [ 2.525224 3.828296 5.439775 ] [ 1.195151 3.273987 3.261847 ] [ 3.958209 2.788765 2.245111 ] [ 4.201729 2.884975 4.427405 ] [ 3.756146 4.818354 3.421856 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.317023e-10 1.146232e-10 2.35214e-10 ] [ 1.137751e-10 1.512768e-10 4.697187e-10 ] [ 2.525224e-10 3.828296e-10 5.439775e-10 ] [ 1.195151e-10 3.273987e-10 3.261847e-10 ] [ 3.958209e-10 2.788765e-10 2.245111e-10 ] [ 4.201729000000001e-10 2.884975e-10 4.427405e-10 ] [ 3.756146e-10 4.818354e-10 3.421856e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5692404 0.4425575 0.9429606 ] [ 0.8926542 -0.9866736 0.6638143 ] [ -2.974395 0.9591714 0.753752 ] [ -0.4643955 1.1703693 -1.2029932 ] [ -0.0446051 -0.3734406 -2.5246965 ] [ 3.9179627 -5.3322375 2.8367985 ] [ -0.7579809 4.1202536 -1.4696357 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.120236680088136e-10 7.09055285701455e-10 1.51078944010262e-09 ] [ 1.430189701481963e-09 -1.580825387304662e-09 1.063547760775066e-09 ] [ -4.76550616928643e-09 1.536762005081068e-09 1.207643842230768e-09 ] [ -7.44043619034747e-10 1.875138345610936e-09 -1.927407595900889e-09 ] [ -7.14652489772334e-11 -5.983178035069404e-10 -4.045009740241581e-09 ] [ 6.27726829082355e-09 -8.543186329438574e-09 4.545052272066248e-09 ] [ -1.21441928699829e-09 6.601374044074382e-09 -2.354615979032234e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.619532064916392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.502524930842281e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0906319 1.2785261 2.2925609 ] [ 1.7937181 1.3766454 4.6711876 ] [ 2.2568798 4.1199103 5.492403 ] [ 1.3663962 3.5015457 3.2296788 ] [ 4.0457146 2.5779238 2.1558832 ] [ 4.0357137 2.5204469 4.5575731 ] [ 3.5021788 4.8783788 3.4460345 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0906319e-10 1.2785261e-10 2.2925609e-10 ] [ 1.7937181e-10 1.3766454e-10 4.6711876e-10 ] [ 2.2568798e-10 4.1199103e-10 5.492403000000001e-10 ] [ 1.3663962e-10 3.5015457e-10 3.2296788e-10 ] [ 4.0457146e-10 2.577923800000001e-10 2.1558832e-10 ] [ 4.0357137e-10 2.5204469e-10 4.5575731e-10 ] [ 3.5021788e-10 4.8783788e-10 3.4460345e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.97e-05 6.7e-06 -1.98e-05 ] [ 6e-07 4.56e-05 4.4e-06 ] [ -4.3e-06 7.5e-06 4e-07 ] [ -5.43e-05 -2.46e-05 2.42e-05 ] [ -1.64e-05 -2.1e-06 3.81e-05 ] [ 4.6e-06 -5.78e-05 -3.08e-05 ] [ 2.02e-05 2.47e-05 -1.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.96281787098e-14 1.07345834478e-14 -3.17230973532e-14 ] [ 9.613059803999998e-16 7.30592545104e-14 7.0495771896e-15 ] [ -6.8893595262e-15 1.2016324755e-14 6.408706536e-16 ] [ -8.69981912262e-14 -3.94135451964e-14 3.877267454279999e-14 ] [ -2.62756967976e-14 -3.364570931399999e-15 6.10429297554e-14 ] [ 7.370012516399999e-15 -9.26058094452e-14 -4.93470403272e-14 ] [ 3.236396800679999e-14 3.95737628598e-14 -2.6435914461e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.047526064916394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.891532456271501e-18 } }