{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -28.3719389 -96.0983877 13.1276353 ] [ -41.8885084 8.8417627 55.7753115 ] [ -37.4336797 25.9600382 -57.501538 ] [ -11.056156 22.66432 1.3641604 ] [ 55.4154737 29.6993507 -61.3827751 ] [ 63.3348093 8.932916 48.617206 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.545685719234607e-08 -1.539665900695143e-07 2.103279036404879e-08 ] [ -6.71127888386644e-08 1.416606548460148e-08 8.936190010313739e-08 ] [ -5.997536644585556e-08 4.159256627911492e-08 -9.212761984364279e-08 ] [ -1.771391465911764e-08 3.631224363032986e-08 2.185625899901177e-09 ] [ 8.878537639269727e-08 4.758360534448011e-08 -9.834604718504439e-08 ] [ 1.014735507432864e-07 1.431210917077025e-08 7.78933508218175e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 44.80091072091806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.1778971747603e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5214575 -0.2666052 1.2513059 ] [ 0.6661922 1.4604961 2.7262056 ] [ 0.5629413 1.6960035 0.1934116 ] [ -0.2802686 3.301069 1.6564815 ] [ 2.9159098 1.3133814 0.1655049 ] [ 3.0108045 1.0969742 2.4932178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5214575e-10 -2.666052e-11 1.2513059e-10 ] [ 6.661922e-11 1.4604961e-10 2.7262056e-10 ] [ 5.629413e-11 1.6960035e-10 1.934116e-11 ] [ -2.802686e-11 3.301069e-10 1.6564815e-10 ] [ 2.9159098e-10 1.3133814e-10 1.655049e-11 ] [ 3.0108045e-10 1.0969742e-10 2.4932178e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.67e-05 4.9e-06 -4.7e-06 ] [ -1.7e-06 9.6e-06 2.35e-05 ] [ -5.1e-06 -1.94e-05 2.1e-06 ] [ -1.54e-05 7.6e-06 -1.17e-05 ] [ 2.56e-05 1.92e-05 -3.3e-06 ] [ 1.33e-05 -2.19e-05 -6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.675634956736e-14 7.850665441919999e-15 -7.53023011776e-15 ] [ -2.72370025536e-15 1.538089555968e-14 3.76511505888e-14 ] [ -8.17110076608e-15 -3.108222644352e-14 3.36457090368e-15 ] [ -2.467351996032e-14 1.217654231808e-14 -1.874546646336e-14 ] [ 4.101572149248001e-14 3.076179111936e-14 -5.28718284864e-15 ] [ 2.130894905664e-14 -3.508766799552e-14 -9.6130597248e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.430605279081938 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.030296543573814e-18 } }