{ "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" [ [ 2.194843 2.698336 1.615904 ] [ 2.342296 1.479956 3.870973 ] [ 2.299802 3.774539 3.510423 ] [ 4.310954 2.51113 2.445623 ] [ 3.93016 4.43603 0.8578151 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.194843e-10 2.698336e-10 1.615904e-10 ] [ 2.342296e-10 1.479956e-10 3.870973000000001e-10 ] [ 2.299802e-10 3.774539e-10 3.510423e-10 ] [ 4.310954e-10 2.51113e-10 2.445623e-10 ] [ 3.93016e-10 4.43603e-10 8.578151e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2220681 -0.8441229 -5.8175912 ] [ -0.2140162 -2.5060311 1.7528462 ] [ -1.2724602 4.3598103 3.9035731 ] [ 4.7008783 -0.8177368 0.1402676 ] [ 0.0076662 -0.1919195 0.0209043 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.162322180445476e-09 -1.352433975461896e-09 -9.320808610011817e-09 ] [ -3.428917521124569e-10 -4.015104439417706e-09 2.808369201498121e-09 ] [ -2.038705983338492e-09 6.985186133783035e-09 6.25421355840378e-09 ] [ 7.531637309486049e-09 -1.310158782927805e-09 2.247334693757261e-10 ] [ 1.228260641037696e-11 -3.074889359756256e-10 3.349238073418944e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7635921 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.564299899764758e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5754253 2.7486677 1.42552 ] [ 2.5707993 1.4491107 3.2705015 ] [ 2.5318571 4.0756797 3.4928614 ] [ 4.6976547 2.6635451 2.9784805 ] [ 3.7023185 3.9629878 1.1333747 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5754253e-10 2.7486677e-10 1.42552e-10 ] [ 2.5707993e-10 1.4491107e-10 3.2705015e-10 ] [ 2.5318571e-10 4.0756797e-10 3.4928614e-10 ] [ 4.6976547e-10 2.6635451e-10 2.9784805e-10 ] [ 3.7023185e-10 3.9629878e-10 1.1333747e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.5e-05 2.57e-05 2.63e-05 ] [ 1.81e-05 5.64e-05 -8.2e-06 ] [ -1.36e-05 -3.14e-05 -6.8e-05 ] [ -2.03e-05 -5.8e-06 -4.78e-05 ] [ -3.92e-05 -4.49e-05 9.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.8119714144e-14 4.117593915456e-14 4.213724512704e-14 ] [ 2.899939683648e-14 9.036276141312001e-14 -1.313784829056e-14 ] [ -2.178960204288e-14 -5.030834589312e-14 -1.089480102144e-13 ] [ -3.252418540224e-14 -9.292624400640001e-15 -7.658404247424001e-14 ] [ -6.280532353535999e-14 -7.193773027392e-14 1.5669287351424e-13 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }