{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.715482 1.558119 0.3191032 ] [ 2.111919 2.384646 2.793656 ] [ 0.6473775 3.949576 0.9928713 ] [ 3.842985 1.188798 1.171985 ] [ 3.145034 3.056438 0.3971002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.715482e-10 1.558119e-10 3.191032e-11 ] [ 2.111919e-10 2.384646e-10 2.793656e-10 ] [ 6.473775000000001e-11 3.949576e-10 9.928713000000001e-11 ] [ 3.842985e-10 1.188798e-10 1.171985e-10 ] [ 3.145034e-10 3.056438e-10 3.971002e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.4668614 -6.9041238 -5.5389456 ] [ -2.2909526 1.0337386 7.5679412 ] [ -1.2903584 1.1241835 0.5482326 ] [ 8.1576443 -7.3934688 3.0777289 ] [ 5.8905281 12.1396705 -5.6549572 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.676976062823396e-08 -1.106162573946885e-08 -8.874369144203027e-09 ] [ -3.670510695080974e-09 1.656231816938523e-09 1.21251784582291e-08 ] [ -2.067382060932895e-09 1.801140521189117e-09 8.78365454480398e-10 ] [ 1.306998697826238e-08 -1.184564285797423e-08 4.931065288740501e-09 ] [ 9.437666405985444e-09 1.944989625931544e-08 -9.06024021746463e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.5109984 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.227416172946208e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2885442 1.200445 0.1273057 ] [ 2.1442543 2.449145 3.0075404 ] [ 1.0676323 3.5198051 1.0253146 ] [ 3.5174906 1.3352288 1.2445772 ] [ 3.4448762 3.6329532 0.2699778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2885442e-10 1.200445e-10 1.273057e-11 ] [ 2.1442543e-10 2.449145e-10 3.0075404e-10 ] [ 1.0676323e-10 3.5198051e-10 1.0253146e-10 ] [ 3.5174906e-10 1.3352288e-10 1.2445772e-10 ] [ 3.4448762e-10 3.6329532e-10 2.699778e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.2e-06 -1.33e-05 1e-07 ] [ -1.13e-05 1.22e-05 2.42e-05 ] [ -7.98e-05 4.41e-05 2.7e-06 ] [ 5.28e-05 -5.4e-05 -1.97e-05 ] [ 3.96e-05 1.1e-05 -7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.92261194496e-15 -2.130894905664e-14 1.6021766208e-16 ] [ -1.810459581504e-14 1.954655477376e-14 3.877267422336e-14 ] [ -1.2785369433984e-13 7.065598897728e-14 4.32587687616e-15 ] [ 8.459492557824e-14 -8.65175375232e-14 -3.156287942976e-14 ] [ 6.344619418368e-14 1.76239428288e-14 -1.169588933184e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }