{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.0379173 -9.7716911 2.7526566 ] [ -1.6661673 1.0104862 1.3075558 ] [ 25.4220167 -21.2882234 -26.1885898 ] [ 13.1819189 -0.8652494 36.7227036 ] [ -22.899851 30.9146778 -14.5943263 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.249122308808437e-08 -1.565597515508575e-08 4.410242085945884e-09 ] [ -2.669494316394868e-09 1.61897737861945e-09 2.094935350411177e-09 ] [ 4.073056114589779e-08 -3.410749411085203e-08 -4.195874665497073e-08 ] [ 2.111976245286298e-08 -1.386282371262519e-09 5.883625764522768e-08 ] [ -3.668960619428153e-08 4.953077441879852e-08 -2.338268858683167e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.3161246536311495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.915194069479171e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7772655 -0.0790112 1.3273667 ] [ 0.0472047 2.7788518 2.0491305 ] [ 2.7667403 0.2824987 0.1760528 ] [ 2.6012097 1.1595067 2.324905 ] [ 1.3995686 2.0410814 0.4924092 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.772655000000001e-11 -7.90112e-12 1.3273667e-10 ] [ 4.720470000000001e-12 2.7788518e-10 2.0491305e-10 ] [ 2.7667403e-10 2.824987e-11 1.760528e-11 ] [ 2.6012097e-10 1.1595067e-10 2.324905e-10 ] [ 1.3995686e-10 2.0410814e-10 4.924092e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.36e-05 -5.7e-06 -6.56e-05 ] [ -0.0001413 9.97e-05 7.63e-05 ] [ -1.35e-05 -0.0001584 -7.24e-05 ] [ 8.67e-05 -6.4e-06 0.0001519 ] [ -2.55e-05 7.09e-05 -9.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.499637329424e-13 -9.1324068138e-15 -1.051027871904e-13 ] [ -2.263875583842e-13 1.597370104098e-13 1.222460771742e-13 ] [ -2.162938455899999e-14 -2.537847788256e-13 -1.159975883016e-13 ] [ 1.389087141678e-13 -1.02539304576e-14 2.433706307046e-13 ] [ -4.0855504167e-14 1.135943233506e-13 -1.445163323868e-13 ] ] } "relaxed-potential-energy" { "source-value" -12.33375504636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.976085414477176e-18 } }