{ "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" [ [ 0.635409 0.2945373 0.4894103 ] [ 0.6913641 0.4672635 2.355287 ] [ 2.952385 0.4157679 2.192681 ] [ 2.385934 1.774442 0.4759126 ] [ 2.093707 2.943435 1.550224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.35409e-11 2.945373e-11 4.894103e-11 ] [ 6.913641e-11 4.672635e-11 2.355287e-10 ] [ 2.952385e-10 4.157679e-11 2.192681e-10 ] [ 2.385934000000001e-10 1.774442e-10 4.759126e-11 ] [ 2.093707e-10 2.943435e-10 1.550224e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6174178 -0.4034487 -6.8724146 ] [ -3.149632 -1.4397007 7.6045385 ] [ 3.997225 -1.0390678 2.5587983 ] [ 3.9545438 -5.8491 -10.2470597 ] [ -2.184719 8.7313171 6.9561375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.193565640575685e-09 -6.463960801576757e-10 -1.101082209128046e-08 ] [ -5.046266796098687e-09 -2.306654821493443e-09 1.218381389705341e-08 ] [ 6.404260495840649e-09 -1.664770150301785e-09 4.099646847378921e-09 ] [ 6.335877674489569e-09 -9.371291349929398e-09 -1.641759961854305e-08 ] [ -3.500305733655846e-09 1.398911224166464e-08 1.114496096539117e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.6141588326896725 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.059705073530011e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5908095 0.3998782 0.3064076 ] [ 0.819363 0.8268125 2.6392902 ] [ 3.0694884 0.2232073 2.1398531 ] [ 2.6841592 1.5313687 0.1861187 ] [ 1.5949789 2.914179 1.7918453 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.908095e-11 3.998782e-11 3.064076e-11 ] [ 8.19363e-11 8.268125e-11 2.6392902e-10 ] [ 3.0694884e-10 2.232073e-11 2.1398531e-10 ] [ 2.6841592e-10 1.5313687e-10 1.861187e-11 ] [ 1.5949789e-10 2.914179e-10 1.7918453e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.87e-05 -8.8e-06 -1.93e-05 ] [ -2.17e-05 -9.3e-06 1.25e-05 ] [ 2.51e-05 2.1e-06 1.73e-05 ] [ 8.9e-06 -6e-06 -2.88e-05 ] [ 6.5e-06 2.2e-05 1.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.99607030558e-14 -1.40991543792e-14 -3.09220090362e-14 ] [ -3.476723295779999e-14 -1.49002426962e-14 2.0027207925e-14 ] [ 4.02146335134e-14 3.364570931399999e-15 2.77176557682e-14 ] [ 1.42593720426e-14 -9.613059803999999e-15 -4.614268705919999e-14 ] [ 1.0414148121e-14 3.5247885948e-14 2.93198324022e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }