{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.368731 -0.1660859 -0.448139 ] [ -0.2611354 0.0251645 0.6396402 ] [ 0.0727075 1.2965621 0.0274758 ] [ -0.1803031 -1.1556406 -0.218977 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 5.907721924314538e-10 -2.660989482168606e-10 -7.179978345841259e-10 ] [ -4.183850361902436e-10 4.0317973906293e-11 1.024816582607087e-09 ] [ 1.16490257616555e-10 2.077321501149971e-09 4.40210847604572e-11 ] [ -2.888774138577653e-10 -1.85154036662174e-09 -3.50839832783418e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.0309534 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.662652618222854e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.222424 2.904477 0.9358623 ] [ 1.38325 0.2248013 2.1428734 ] [ 2.5111858 5.5673563 2.1344228 ] [ 3.186391 3.7192152 3.3160685 ] [ 3.2087932 1.5475283 2.5736883 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.38325e-10 2.248013e-11 2.1428734e-10 ] [ 2.5111858e-10 5.567356300000001e-10 2.1344228e-10 ] [ 3.186391e-10 3.7192152e-10 3.3160685e-10 ] [ 3.2087932e-10 1.5475283e-10 2.5736883e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 -2.9e-06 -1e-06 ] [ -1.2e-06 8.1e-06 -3e-07 ] [ 2e-06 -3e-07 -1.2e-06 ] [ -8e-07 -4.9e-06 2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 -4.6463122386e-15 -1.602176634e-15 ] [ -1.9226119608e-15 1.29776307354e-14 -4.806529901999999e-16 ] [ 3.204353268e-15 -4.806529901999999e-16 -1.9226119608e-15 ] [ -1.2817413072e-15 -7.850665506599998e-15 4.005441585e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.9978218 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.281392321085582e-18 } }