{ "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" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7225613 -8.9519531 -12.541674 ] [ -18.4450933 -17.2939765 5.3601466 ] [ 5.1799405 10.795629 11.2310146 ] [ -7.4050661 15.3939497 -1.3268672 ] [ 0.6394474 -6.7013883 -2.8966508 ] [ 17.1356678 4.5070398 -6.3050845 ] [ 2.1725424 2.2506995 6.4791154 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.157670821954855e-09 -1.434260996731809e-08 -2.009397686849522e-08 ] [ -2.955229725373472e-08 -2.770800482896461e-08 8.58790156658061e-09 ] [ 8.299179566235063e-09 1.729650439063049e-08 1.799406901998346e-08 ] [ -1.186422378089863e-08 2.466382631111117e-08 -2.125875606746358e-09 ] [ 1.024507674511346e-09 -1.073680766116266e-08 -4.640946190381617e-09 ] [ 2.745436633095537e-08 7.221073796575108e-09 -1.010185897806846e-08 ] [ 3.480796640976723e-09 3.60601811934625e-09 1.038068721734524e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.620775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.861853402057712e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2909089 0.8863333 1.8339394 ] [ 0.7571602 1.162021 3.8874809 ] [ 2.3235193 2.6406939 5.3362579 ] [ 1.9529314 3.4169839 2.8635568 ] [ 4.3894966 -0.0046802 3.0370378 ] [ 4.3568885 2.6448336 2.3007504 ] [ 4.65658 1.891257 4.7900328 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2909089e-10 8.863333e-11 1.8339394e-10 ] [ 7.571602e-11 1.162021e-10 3.8874809e-10 ] [ 2.3235193e-10 2.6406939e-10 5.3362579e-10 ] [ 1.9529314e-10 3.4169839e-10 2.8635568e-10 ] [ 4.389496600000001e-10 -4.6802e-13 3.0370378e-10 ] [ 4.3568885e-10 2.6448336e-10 2.3007504e-10 ] [ 4.65658e-10 1.891257e-10 4.7900328e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.71e-05 1.63e-05 3.91e-05 ] [ 7.7e-06 3.96e-05 -1.31e-05 ] [ -1.95e-05 -4.48e-05 -4.72e-05 ] [ 2.72e-05 -4.86e-05 -4e-07 ] [ -9.8e-06 -1.96e-05 8e-06 ] [ -2.8e-05 3.99e-05 1.3e-06 ] [ 3.95e-05 1.71e-05 1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.739722021568e-14 2.611547891904e-14 6.264510587328001e-14 ] [ 1.233675998016e-14 6.344619418368e-14 -2.098851373248e-14 ] [ -3.12424441056e-14 -7.177751261183999e-14 -7.562273650176e-14 ] [ 4.357920408576e-14 -7.786578377088e-14 -6.408706483200001e-16 ] [ -1.570133088384e-14 -3.140266176767999e-14 1.28174129664e-14 ] [ -4.48609453824e-14 6.392684716992e-14 2.08282960704e-15 ] [ 6.32859765216e-14 2.739722021568e-14 1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.737843 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.803221708282094e-18 } }