{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4253986 -0.0652429 -0.1868571 ] [ -1.4325213 -0.2435878 0.4082407 ] [ -0.2892255 0.0286503 0.130069 ] [ 0.1899287 0.1633105 -0.3095523 ] [ 2.220671 -1.401817 -1.0705452 ] [ 0.0254359 2.1996684 1.2031397 ] [ -0.2888902 -0.6809815 -0.1744948 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.81563691441051e-10 -1.045306490531923e-10 -2.993780770504876e-10 ] [ -2.295152135658023e-09 -3.902706782721063e-10 6.540737051990265e-10 ] [ -4.633903342391905e-10 4.590284083890624e-11 2.083935108908352e-10 ] [ 3.04299322758937e-10 2.616522650311584e-10 -4.959574579748679e-10 ] [ 3.557907158688557e-09 -2.245958424039994e-09 -1.71520249094966e-09 ] [ 4.075280430900672e-11 3.524257283992543e-09 1.927642298896326e-09 ] [ -4.628531244182362e-10 -1.091052638497315e-09 -2.795714890111719e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.554028 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.453335974566858e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.674695 2.8899661 3.1946175 ] [ 2.6941966 0.7382328 5.1827201 ] [ 1.8150255 0.576544 3.0386956 ] [ 3.9875734 0.7765071 2.1410802 ] [ 4.8527825 0.9367176 4.2908968 ] [ 3.5696689 2.956774 4.7150337 ] [ 3.8331651 3.0886607 2.3025492 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.674695e-10 2.8899661e-10 3.1946175e-10 ] [ 2.6941966e-10 7.382328e-11 5.182720100000001e-10 ] [ 1.8150255e-10 5.76544e-11 3.0386956e-10 ] [ 3.9875734e-10 7.765071000000001e-11 2.1410802e-10 ] [ 4.852782500000001e-10 9.367176e-11 4.2908968e-10 ] [ 3.5696689e-10 2.956774e-10 4.7150337e-10 ] [ 3.8331651e-10 3.0886607e-10 2.3025492e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.22e-05 -2.43e-05 -2.29e-05 ] [ -3.7e-06 1.38e-05 1.4e-05 ] [ 5.55e-05 1.19e-05 2.63e-05 ] [ -3.32e-05 2.75e-05 -4.7e-06 ] [ -4.22e-05 6.1e-06 -2.47e-05 ] [ -1.43e-05 -2.69e-05 -5e-07 ] [ -4.3e-06 -8e-06 1.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.761185339776e-14 -3.893289188544e-14 -3.668984461632e-14 ] [ -5.928053496960001e-15 2.211003736704e-14 2.24304726912e-14 ] [ 8.892080245440001e-14 1.906590178752e-14 4.213724512704e-14 ] [ -5.319226381056e-14 4.4059857072e-14 -7.53023011776e-15 ] [ -6.761185339776e-14 9.77327738688e-15 -3.957376253376001e-14 ] [ -2.291112567744e-14 -4.309855109952001e-14 -8.010883104e-16 ] [ -6.889359469440001e-15 -1.28174129664e-14 2.002720776e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993258982137e-18 } }