{ "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" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0712129 -2.7578995 2.9635481 ] [ -0.2824756 3.1185025 -0.3879589 ] [ -4.7535869 0.6689128 -3.422459 ] [ 0.7662847 4.0140868 1.8888988 ] [ 3.8104184 -4.0590575 -1.7539915 ] [ 0.210095 -0.6375345 0.908136 ] [ 1.3204775 -0.3470105 -0.1961735 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.716272264279368e-09 -4.418642101416011e-09 4.748127480436261e-09 ] [ -4.525758022664525e-10 4.996391797406353e-09 -6.215786794112851e-10 ] [ -7.616085796121148e-09 1.071716449513866e-09 -5.483383795446548e-09 ] [ 1.227723431216742e-09 6.431276024821886e-09 3.026349496417175e-09 ] [ 6.104963275946143e-09 -6.503327028982896e-09 -2.810204174381923e-09 ] [ 3.36609297146976e-10 -1.021442870853418e-09 1.454994267706829e-09 ] [ 2.115638178792432e-09 -5.559721102721184e-10 -3.143045953205088e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.918084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.031011189513055e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3059451 3.4277426 3.4369611 ] [ 2.5780252 5.7185358 1.3974156 ] [ 1.4264647 3.659528 1.1331629 ] [ 2.4604314 5.4920635 3.7018922 ] [ 3.4510095 2.5308899 1.0773756 ] [ 4.6055379 4.5951998 1.342328 ] [ 3.8069851 3.4065734 3.3934176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3059451e-10 3.427742600000001e-10 3.4369611e-10 ] [ 2.5780252e-10 5.7185358e-10 1.3974156e-10 ] [ 1.4264647e-10 3.659528e-10 1.1331629e-10 ] [ 2.4604314e-10 5.492063500000001e-10 3.7018922e-10 ] [ 3.4510095e-10 2.5308899e-10 1.0773756e-10 ] [ 4.6055379e-10 4.5951998e-10 1.342328e-10 ] [ 3.8069851e-10 3.4065734e-10 3.3934176e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.77e-05 -6.2e-06 -4.9e-06 ] [ -3.3e-05 5.5e-06 -1.3e-06 ] [ 1.08e-05 2.19e-05 1.23e-05 ] [ 2.47e-05 1.02e-05 1.04e-05 ] [ 5.17e-05 1.1e-06 -1.91e-05 ] [ -1.61e-05 -3.66e-05 -1.98e-05 ] [ -2.05e-05 4.2e-06 2.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.835852618816e-14 -9.93349504896e-15 -7.850665441919999e-15 ] [ -5.28718284864e-14 8.8119714144e-15 -2.08282960704e-15 ] [ 1.730350750464e-14 3.508766799552e-14 1.970677243584e-14 ] [ 3.957376253376001e-14 1.634220153216e-14 1.666263685632e-14 ] [ 8.283253129536002e-14 1.76239428288e-15 -3.060157345728e-14 ] [ -2.579504359488e-14 -5.863966432128e-14 -3.172309709184e-14 ] [ -3.28446207264e-14 6.72914180736e-15 3.588875630592e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.303661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573440421244875e-18 } }