{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1371245 -9.5707618 0.3596895 ] [ -4.1161289 4.8836586 -5.3867677 ] [ -7.6082039 8.0655941 2.3241119 ] [ 4.0565107 -6.00505 -1.2852631 ] [ 0.2421423 -0.8205905 -0.5950735 ] [ 10.6839046 5.3629311 -2.2947286 ] [ 1.8788998 -1.9157813 6.8780314 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.230580772038888e-09 -1.533405079920572e-08 5.762861076472416e-10 ] [ -6.59476549177922e-09 7.82448363288886e-09 -8.630553270620589e-09 ] [ -1.218968641485938e-08 1.292250629988242e-08 3.723637750303068e-09 ] [ 6.499246605565042e-09 -9.621150716735039e-09 -2.059218490396932e-09 ] [ 3.879547319667398e-10 -1.314730914350582e-09 -9.53412849357629e-10 ] [ 1.711750216897758e-08 8.592362827381227e-09 -3.676560514001115e-09 ] [ 3.010329332385796e-09 -3.069420009425831e-09 1.101982110620829e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -19.27059 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.087488876702227e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2997187 1.9956841 2.8185868 ] [ 2.4712424 3.8034589 0.9057667 ] [ 2.1370531 4.5871273 3.2815397 ] [ 4.1448638 1.9144955 0.9357091 ] [ 4.8450473 1.5307356 3.3299763 ] [ 4.5812137 4.0116569 2.4745219 ] [ 3.6041481 3.1824947 4.7797827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2997187e-10 1.9956841e-10 2.8185868e-10 ] [ 2.4712424e-10 3.8034589e-10 9.057667e-11 ] [ 2.1370531e-10 4.5871273e-10 3.281539700000001e-10 ] [ 4.1448638e-10 1.9144955e-10 9.357091e-11 ] [ 4.8450473e-10 1.5307356e-10 3.3299763e-10 ] [ 4.5812137e-10 4.011656900000001e-10 2.4745219e-10 ] [ 3.6041481e-10 3.1824947e-10 4.7797827e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.32e-05 1.17e-05 -1.15e-05 ] [ -3.77e-05 2.94e-05 -2.51e-05 ] [ 7.8e-06 -2e-06 -1.95e-05 ] [ -7e-06 4.3e-05 -1.38e-05 ] [ 2e-05 -1.24e-05 3.43e-05 ] [ -4.41e-05 -0.0001007 2.3e-05 ] [ 7.8e-06 3.09e-05 1.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.523579622656e-14 1.874546646336e-14 -1.84250311392e-14 ] [ -6.040205860416e-14 4.710399265152e-14 -4.021463318208e-14 ] [ 1.249697764224e-14 -3.2043532416e-15 -3.12424441056e-14 ] [ -1.12152363456e-14 6.889359469439999e-14 -2.211003736704e-14 ] [ 3.2043532416e-14 -1.986699009792e-14 5.495465809344e-14 ] [ -7.065598897728e-14 -1.6133918571456e-13 3.68500622784e-14 ] [ 1.249697764224e-14 4.950725758272e-14 2.018742542208e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.454184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.917992188554143e-18 } }