{ "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" [ [ 1.30949 2.712734 2.978333 ] [ 0.0672006 1.690783 1.932827 ] [ 2.539316 0.8650755 1.245634 ] [ 2.964133 0.3086468 2.850804 ] [ 2.353048 2.858216 0.4219119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.30949e-10 2.712734e-10 2.978333e-10 ] [ 6.72006e-12 1.690783e-10 1.932827e-10 ] [ 2.539316e-10 8.650755e-11 1.245634e-10 ] [ 2.964133e-10 3.086468e-11 2.850804e-10 ] [ 2.353048e-10 2.858216e-10 4.219119e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.8250919 3.8966529 3.7736448 ] [ -4.5562357 -4.6678447 -4.3854442 ] [ -4.4365205 3.7841223 -14.879691 ] [ 3.5023791 -4.7845282 15.6196188 ] [ -0.3347148 1.7715979 -0.1281283 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.332826056191452e-09 6.24312617575252e-09 6.046045473763492e-09 ] [ -7.299894317394323e-09 -7.47871164786519e-09 -7.02625616906296e-09 ] [ -7.108089422799928e-09 6.062832279307925e-09 -2.383989304492817e-08 ] [ 5.611429911198545e-09 -7.665659223598306e-09 2.502538806716815e-08 ] [ -5.362722271957479e-10 2.838412736838376e-09 -2.052841667228487e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 1.1776206007650512 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.886756194718216e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7801229 2.4290242 2.9711603 ] [ 0.1338175 1.7947353 1.3862396 ] [ 2.2093653 0.6779579 1.1225127 ] [ 3.1217231 0.5367082 3.2716245 ] [ 1.9881589 2.9970298 0.6779728 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7801229e-10 2.4290242e-10 2.971160300000001e-10 ] [ 1.338175e-11 1.7947353e-10 1.3862396e-10 ] [ 2.2093653e-10 6.779579e-11 1.1225127e-10 ] [ 3.1217231e-10 5.367082e-11 3.2716245e-10 ] [ 1.9881589e-10 2.9970298e-10 6.779728000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.77e-05 2.99e-05 8.8e-06 ] [ 4.99e-05 -3.06e-05 1.17e-05 ] [ -5.91e-05 3.94e-05 -3.07e-05 ] [ 8.2e-06 1.7e-05 -2.29e-05 ] [ 3.88e-05 -5.58e-05 3.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.040205860416e-14 4.790508096192e-14 1.409915426304e-14 ] [ 7.994861337792e-14 -4.902660459647999e-14 1.874546646336e-14 ] [ -9.468863828927999e-14 6.312575885952001e-14 -4.918682225856e-14 ] [ 1.313784829056e-14 2.72370025536e-14 -3.668984461632e-14 ] [ 6.216445288704e-14 -8.940145544064e-14 5.319226381056e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.057896399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.103643361282738e-19 } }