{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0251564 0.6941165 0.4465085 ] [ 0.3172663 0.1337315 1.61278 ] [ 0.5869901 2.638721 0.7880578 ] [ 2.963349 2.149596 1.324349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.51564e-12 6.941165e-11 4.465085e-11 ] [ 3.172663e-11 1.337315e-11 1.61278e-10 ] [ 5.869901e-11 2.638721e-10 7.880578e-11 ] [ 2.963349e-10 2.149596e-10 1.324349e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.2078789 34.4598684 -76.2509203 ] [ 18.5846007 -39.983881 76.925451 ] [ 2.6846332 4.7508344 -0.4928294 ] [ -1.0613551 0.7731782 -0.1817013 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.237659139628162e-08 5.521079596119496e-08 -1.221674428256563e-07 ] [ 2.977581299376004e-08 -6.406123987483654e-08 1.232481601521119e-07 ] [ 4.301256583900648e-09 7.611675867683408e-09 -7.895997492282394e-10 ] [ -1.700478341596733e-09 1.238768045958179e-09 -2.911175772274242e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 17.692571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.834662385158601e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3055395 0.9045091 0.5217984 ] [ -0.0773999 -0.9143891 1.9028768 ] [ 1.104118 2.7106716 0.3857862 ] [ 3.1715831 2.9153735 1.3612339 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.055395000000001e-11 9.045091e-11 5.217984e-11 ] [ -7.73999e-12 -9.143891e-11 1.9028768e-10 ] [ 1.104118e-10 2.7106716e-10 3.857862e-11 ] [ 3.1715831e-10 2.9153735e-10 1.3612339e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-05 1.26e-05 9.7e-06 ] [ -1.83e-05 -1.14e-05 -6.2e-06 ] [ -1.05e-05 -2.17e-05 3e-07 ] [ 1.18e-05 2.04e-05 -3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.723700277799999e-14 2.01874255884e-14 1.55411133498e-14 ] [ -2.93198324022e-14 -1.82648136276e-14 -9.9334951308e-15 ] [ -1.6822854657e-14 -3.476723295779999e-14 4.806529901999999e-16 ] [ 1.89056842812e-14 3.26844033336e-14 -5.9280535458e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.9978218 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.281392321085582e-18 } }