{ "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" [ [ 0.1854996 0.4736791 1.206297 ] [ 0.6742688 0.1009159 2.297624 ] [ 0.6067687 1.83215 2.754335 ] [ 0.1838578 2.712055 1.507331 ] [ 1.981528 1.354685 0.3328332 ] [ 2.901733 2.736996 1.329123 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.854996e-11 4.736791e-11 1.206297e-10 ] [ 6.742688e-11 1.009159e-11 2.297624e-10 ] [ 6.067687000000001e-11 1.83215e-10 2.754335e-10 ] [ 1.838578e-11 2.712055e-10 1.507331e-10 ] [ 1.981528e-10 1.354685e-10 3.328332e-11 ] [ 2.901733e-10 2.736996e-10 1.329123e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -189.3781736 129.3320664 -435.7384097 ] [ 186.2132441 -161.1945775 416.8000042 ] [ 51.2980656 -67.5852329 161.665527 ] [ -44.7459803 97.3764486 -141.9886947 ] [ -23.8754674 -29.6070338 -24.430008 ] [ 20.4883115 31.6783292 23.6915811 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.034172847315156e-07 2.072128148130165e-07 -6.981298985576589e-07 ] [ 2.983465086383583e-07 -2.582621855980021e-07 6.677872277803417e-07 ] [ 8.218856207371918e-08 -1.08283480955828e-07 2.590167298826961e-07 ] [ -7.16909641020843e-08 1.56014270648822e-07 -2.274909689404996e-07 ] [ -3.825271599410873e-08 -4.743569775640823e-08 -3.914118798603307e-08 ] [ 3.282589395541349e-08 5.075427884839991e-08 3.795809766093602e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 189.4726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.035685725032284e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.0474504 0.5851802 0.5082507 ] [ 0.4894022 -0.2772591 2.8156942 ] [ 1.1986963 2.0395457 3.4924976 ] [ -0.1253672 2.9473914 1.3970216 ] [ 2.4093927 1.00061 -0.207339 ] [ 2.5140815 2.9150127 1.421418 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.74504e-12 5.851802e-11 5.082507e-11 ] [ 4.894022000000001e-11 -2.772591e-11 2.8156942e-10 ] [ 1.1986963e-10 2.0395457e-10 3.4924976e-10 ] [ -1.253672e-11 2.9473914e-10 1.3970216e-10 ] [ 2.4093927e-10 1.00061e-10 -2.07339e-11 ] [ 2.5140815e-10 2.9150127e-10 1.421418e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.39e-05 -6e-06 -2e-07 ] [ -1.7e-06 1.23e-05 -2e-07 ] [ 1.11e-05 4e-07 -2.85e-05 ] [ -7.3e-06 1.4e-06 4.1e-06 ] [ -1.13e-05 9.4e-06 9.4e-06 ] [ -4.7e-06 -1.75e-05 1.53e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.22702552126e-14 -9.613059803999999e-15 -3.204353268e-16 ] [ -2.7237002778e-15 1.97067725982e-14 -3.204353268e-16 ] [ 1.77841606374e-14 6.408706536e-16 -4.5662034069e-14 ] [ -1.16958894282e-14 2.2430472876e-15 6.568924199399999e-15 ] [ -1.81045959642e-14 1.50604603596e-14 1.50604603596e-14 ] [ -7.530230179799999e-15 -2.8038091095e-14 2.45133025002e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.625291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.144318267565049e-18 } }