{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -82.3699544 81.6885653 -159.2332217 ] [ 23.3599037 -44.7453969 194.0454635 ] [ 63.8344651 -35.6624076 -34.3839399 ] [ -167.6796417 162.7440029 -177.9079712 ] [ 162.8552272 -164.0247637 177.4796693 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.319712151960421e-07 1.308795095103541e-07 -2.551197450624032e-07 ] [ 3.742669157227941e-08 -7.16900288015968e-08 3.108951049919998e-07 ] [ 1.022740875844935e-07 -5.713747569816024e-08 -5.508914463877229e-08 ] [ -2.686524017158608e-07 2.607446366217874e-07 -2.850399921105997e-07 ] [ 2.609228375949123e-07 -2.627966416323845e-07 2.843537768197755e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 123.71217 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.982087464824351e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.0336432 0.974117 0.8996452 ] [ 0.3197467 0.3801146 3.3540482 ] [ 2.045294 -0.3847363 0.3222705 ] [ 1.4543892 3.0181065 1.230851 ] [ 2.5799233 1.0348825 2.3718366 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.36432e-12 9.74117e-11 8.996452e-11 ] [ 3.197467e-11 3.801146e-11 3.3540482e-10 ] [ 2.045294e-10 -3.847363e-11 3.222705e-11 ] [ 1.4543892e-10 3.0181065e-10 1.230851e-10 ] [ 2.5799233e-10 1.0348825e-10 2.3718366e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.87e-05 1.13e-05 -3.25e-05 ] [ 2.38e-05 6.1e-06 2.97e-05 ] [ 3.91e-05 -2.09e-05 8e-06 ] [ 7.5e-06 1.93e-05 1.96e-05 ] [ -3.17e-05 -1.58e-05 -2.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.200423522496e-14 1.810459581504e-14 -5.207074017599999e-14 ] [ 3.813180357504e-14 9.77327738688e-15 4.758464563776e-14 ] [ 6.264510587328001e-14 -3.348549137472e-14 1.28174129664e-14 ] [ 1.2016324656e-14 3.092200878144e-14 3.140266176767999e-14 ] [ -5.078899887936e-14 -2.531439060864e-14 -3.973398019584e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.739293 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.52171272725211e-18 } }