{ "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" [ [ 0.5231689 0.1640524 1.493785 ] [ 2.625554 0.0718253 0.0473088 ] [ 2.391634 1.372958 2.83206 ] [ 1.806242 1.946446 0.9821647 ] [ 1.54049 2.8226 2.60214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.231689000000001e-11 1.640524e-11 1.493785e-10 ] [ 2.625554e-10 7.18253e-12 4.73088e-12 ] [ 2.391634e-10 1.372958e-10 2.83206e-10 ] [ 1.806242e-10 1.946446e-10 9.821647e-11 ] [ 1.54049e-10 2.8226e-10 2.60214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.505356 -2.0312038 -0.2384995 ] [ -0.020855 -1.6280148 -0.5667135 ] [ 18.7946505 -30.4334589 11.9334294 ] [ 0.5405097 -2.6898552 -21.5453826 ] [ -18.8089492 36.7825327 10.4171661 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.096695683810048e-10 -3.254347240440119e-09 -3.821183229724896e-10 ] [ -3.3413393426784e-11 -2.608367250876388e-09 -9.079751203917407e-10 ] [ 3.011234962720703e-08 -4.875977633965769e-08 1.911946159064737e-08 ] [ 8.659920046556217e-10 -4.309623114777308e-09 -3.451950828791112e-08 ] [ -3.013525867005486e-08 5.893211394575149e-08 1.669013998041032e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.87950393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.40912063454772e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1337438 -0.032212 1.6285924 ] [ 2.6655467 0.2451185 -0.1655182 ] [ 1.8409771 1.0363446 3.5735981 ] [ 1.2717756 2.0600748 0.4712756 ] [ 1.9750456 3.0685557 2.4495107 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1337438e-10 -3.2212e-12 1.6285924e-10 ] [ 2.6655467e-10 2.451185e-11 -1.655182e-11 ] [ 1.8409771e-10 1.0363446e-10 3.5735981e-10 ] [ 1.2717756e-10 2.0600748e-10 4.712756e-11 ] [ 1.9750456e-10 3.0685557e-10 2.4495107e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 -2.9e-06 1.13e-05 ] [ -5e-07 -4.4e-06 -1.71e-05 ] [ -3.8e-06 1.23e-05 3.6e-06 ] [ 2.8e-06 3.7e-06 -1.46e-05 ] [ -2.1e-06 -8.7e-06 1.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.76783583488e-15 -4.646312200320001e-15 1.810459581504e-14 ] [ -8.010883104e-16 -7.04957713152e-15 -2.739722021568e-14 ] [ -6.08827115904e-15 1.970677243584e-14 5.76783583488e-15 ] [ 4.48609453824e-15 5.928053496960001e-15 -2.339177866368e-14 ] [ -3.36457090368e-15 -1.393893660096e-14 2.675634956736e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.846255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.21841460466351e-18 } }