{ "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" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.2306566 -14.3605271 -1.4643125 ] [ -0.9249353 -1.8108223 -1.0037517 ] [ -10.1196164 18.6846129 5.5418408 ] [ -2.4152174 0.7968996 7.8094234 ] [ 13.8457642 -13.6010631 -4.992816 ] [ 8.8446616 10.2908999 -5.890384 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.478914219915322e-08 -2.300810078198483e-08 -2.3460872530452e-09 ] [ -1.481909713412634e-09 -2.901257153483284e-09 -1.608187506828255e-09 ] [ -1.621341280754426e-08 2.993604995707809e-08 8.87900776595557e-09 ] [ -3.869604852429362e-09 1.276773908244872e-09 1.251207559340845e-08 ] [ 2.218335969834962e-08 -2.179130531684557e-08 -7.999373067156174e-09 ] [ 1.417071003440752e-08 1.648783922677306e-08 -9.437435532334388e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.5716732 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.373333440217792e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8985424 0.2885539 0.4933693 ] [ 0.0994125 -0.0497901 2.6827207 ] [ 0.9461862 2.7736838 1.0202831 ] [ 0.3711959 2.2051148 3.2321899 ] [ 3.2148472 0.4391255 0.0953193 ] [ 3.2039027 2.7618978 0.3502399 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.985424e-11 2.885539e-11 4.933693000000001e-11 ] [ 9.941250000000001e-12 -4.97901e-12 2.6827207e-10 ] [ 9.461862e-11 2.7736838e-10 1.0202831e-10 ] [ 3.711959000000001e-11 2.2051148e-10 3.2321899e-10 ] [ 3.2148472e-10 4.391255e-11 9.53193e-12 ] [ 3.2039027e-10 2.7618978e-10 3.502399e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.31e-05 -0.000101 -5.12e-05 ] [ -9.2e-06 2.78e-05 8.1e-06 ] [ -2.13e-05 6.27e-05 2.88e-05 ] [ -1.13e-05 2.73e-05 3.59e-05 ] [ 3.1e-05 -9e-06 -3.84e-05 ] [ -2.3e-06 -7.8e-06 1.68e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.098851373248e-14 -1.618198387008e-13 -8.203144298496001e-14 ] [ -1.474002491136e-14 4.454051005824e-14 1.297763062848e-14 ] [ -3.412636202304e-14 1.0045647412416e-13 4.614268667904e-14 ] [ -1.810459581504e-14 4.373942174784e-14 5.751814068672e-14 ] [ 4.96674752448e-14 -1.44195895872e-14 -6.152358223872e-14 ] [ -3.68500622784e-15 -1.249697764224e-14 2.691656722944e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.979175 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.040799046707184e-18 } }