{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8448473 -5.6321414 0.5245166 ] [ -5.358806 8.8949559 -3.3178622 ] [ -8.1925547 -3.8613207 1.1936771 ] [ 1.6639019 -1.2154727 -4.0389424 ] [ 1.3875078 1.9066651 6.063416 ] [ 0.7445538 -2.039614 0.2978547 ] [ 6.9105498 1.9469277 -0.7226597 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.557947871357988e-09 -9.023685350464047e-09 8.403682406651243e-10 ] [ -8.585753759339003e-09 1.425129050344044e-08 -5.315801291671835e-09 ] [ -1.312591971310688e-08 -6.186517801920523e-09 1.912481558160881e-09 ] [ 2.665864745448204e-09 -1.947401959204892e-09 -6.471099139351881e-09 ] [ 2.223032576652745e-09 3.054814272083273e-09 9.714663437421743e-09 ] [ 1.192906701115909e-09 -3.267821893179275e-09 4.772158406670797e-10 ] [ 1.107192141765337e-08 3.119322069027361e-09 -1.15782848567345e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.491415 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.841127660459711e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6189306 2.3290284 3.5513078 ] [ 1.4110167 5.5324054 2.8580788 ] [ 0.6692134 3.3221109 2.2105389 ] [ 2.7621339 2.8777723 0.9042863 ] [ 2.9655511 4.5550886 4.5616855 ] [ 4.8686361 2.5912501 2.3573321 ] [ 3.8191557 4.9359472 2.1586606 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6189306e-10 2.3290284e-10 3.5513078e-10 ] [ 1.4110167e-10 5.532405400000001e-10 2.8580788e-10 ] [ 6.692134e-11 3.3221109e-10 2.2105389e-10 ] [ 2.7621339e-10 2.8777723e-10 9.042863e-11 ] [ 2.9655511e-10 4.555088600000001e-10 4.5616855e-10 ] [ 4.8686361e-10 2.5912501e-10 2.3573321e-10 ] [ 3.8191557e-10 4.935947200000001e-10 2.1586606e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.01e-05 1.13e-05 -1.18e-05 ] [ -7.8e-06 -6e-07 1.24e-05 ] [ -6.1e-06 5.3e-06 8.3e-06 ] [ 1.09e-05 4e-06 1.7e-06 ] [ -1.28e-05 2e-07 -2.4e-06 ] [ 6.6e-06 -1.98e-05 6.4e-06 ] [ -8e-07 -4e-07 -1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.61819840034e-14 1.81045959642e-14 -1.89056842812e-14 ] [ -1.24969777452e-14 -9.613059803999998e-16 1.98669902616e-14 ] [ -9.773277467399999e-15 8.4915361602e-15 1.32980660622e-14 ] [ 1.74637253106e-14 6.408706535999999e-15 2.7237002778e-15 ] [ -2.05078609152e-14 3.204353268e-16 -3.845223921599999e-15 ] [ 1.05743657844e-14 -3.17230973532e-14 1.02539304576e-14 ] [ -1.2817413072e-15 -6.408706536e-16 -2.33917788564e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.988725 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.721893823645165e-18 } }