{ "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" [ [ 0.9312002 0.7437347 1.637203 ] [ 0.2868751 2.587784 1.486301 ] [ 2.468756 0.0419283 1.950884 ] [ 2.101698 2.93019 0.1307908 ] [ 2.374683 2.856414 2.678274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.312002000000001e-11 7.437347e-11 1.637203e-10 ] [ 2.868751e-11 2.587784e-10 1.486301e-10 ] [ 2.468756e-10 4.19283e-12 1.950884e-10 ] [ 2.101698e-10 2.93019e-10 1.307908e-11 ] [ 2.374683e-10 2.856414e-10 2.678274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.7273516 1.3162053 -2.3779788 ] [ -1.9583886 5.9427063 0.0059707 ] [ 11.8304808 -3.0248317 3.2344193 ] [ -0.1686137 -0.9037918 1.7585992 ] [ -0.9761269 -3.3302881 -2.6210103 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.398275869502147e-08 2.10879335983305e-09 -3.809942038118039e-09 ] [ -3.137684429361243e-09 9.521265098140872e-09 9.56611594981056e-12 ] [ 1.895451975058328e-08 -4.84631463159472e-09 5.182110984324302e-09 ] [ -2.70148928086585e-10 -1.44803409203075e-09 2.817586523597583e-09 ] [ -1.56392769811398e-09 -5.335709734348453e-09 -4.199321425535994e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.268365 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.286044082004099e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.639781 0.7884349 1.5733316 ] [ 0.2854986 3.1140492 1.4648675 ] [ 2.9797846 0.5499725 1.6885153 ] [ 2.1853187 2.3042882 0.3331754 ] [ 2.0728294 2.4033062 2.8235629 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.397810000000001e-11 7.884349000000001e-11 1.5733316e-10 ] [ 2.854986e-11 3.1140492e-10 1.4648675e-10 ] [ 2.9797846e-10 5.499725e-11 1.6885153e-10 ] [ 2.1853187e-10 2.3042882e-10 3.331754e-11 ] [ 2.0728294e-10 2.4033062e-10 2.8235629e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.4e-06 2.76e-05 9.9e-06 ] [ -0.0 -6.6e-06 4.9e-06 ] [ 2.76e-05 -3.1e-05 4.9e-06 ] [ -6e-06 1.22e-05 -7.5e-06 ] [ -2.4e-05 -2.3e-06 -1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.84522388992e-15 4.422007473408001e-14 1.586154854592e-14 ] [ 0.0 -1.057436569728e-14 7.850665441919999e-15 ] [ 4.422007473408001e-14 -4.96674752448e-14 7.850665441919999e-15 ] [ -9.6130597248e-15 1.954655477376e-14 -1.2016324656e-14 ] [ -3.84522388992e-14 -3.68500622784e-15 -1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }