{ "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" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.429623 -5.9526288 -12.2563941 ] [ -9.4889637 12.1373976 -1.7514371 ] [ -3.0822175 -0.971902 6.0183618 ] [ 2.369472 -11.4717703 8.0881321 ] [ 10.7415104 -0.9826904 -6.8345785 ] [ 5.8898218 7.2415939 6.7359159 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.030139165115796e-08 -9.53716269566076e-09 -1.963690808233106e-08 ] [ -1.520299579575986e-08 1.944625467207403e-08 -2.806111574421752e-09 ] [ -4.938256818720624e-09 -1.557158662108762e-09 9.642478571475806e-09 ] [ 3.796312642040218e-09 -1.83798021738478e-08 1.295861615656201e-08 ] [ 1.720979683496006e-08 -1.5744435843646e-09 -1.095020188572233e-08 ] [ 9.436534788638172e-09 1.160231244390789e-08 1.079212697465499e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1237145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.606918962753962e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8219325 1.2446761 -0.1928039 ] [ 0.0848087 3.0040784 1.0605287 ] [ 0.7003008 1.8083201 3.1011059 ] [ 1.43743 0.0489189 1.8477745 ] [ 3.0605196 1.5101942 0.75103 ] [ 2.3233972 3.2695945 2.0043666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.219325e-11 1.2446761e-10 -1.928039e-11 ] [ 8.48087e-12 3.0040784e-10 1.0605287e-10 ] [ 7.003008e-11 1.8083201e-10 3.1011059e-10 ] [ 1.43743e-10 4.89189e-12 1.8477745e-10 ] [ 3.0605196e-10 1.5101942e-10 7.5103e-11 ] [ 2.3233972e-10 3.2695945e-10 2.0043666e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.7e-06 -6.9e-06 5.9e-06 ] [ 5.8e-06 -6.4e-06 1.22e-05 ] [ 6e-07 5.1e-06 -1.26e-05 ] [ -1.01e-05 -0.0 -6.6e-06 ] [ 8.6e-06 5.5e-06 2.6e-06 ] [ -2.1e-06 2.6e-06 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.32587687616e-15 -1.105501868352e-14 9.45284206272e-15 ] [ 9.292624400640001e-15 -1.025393037312e-14 1.954655477376e-14 ] [ 9.6130597248e-16 8.17110076608e-15 -2.018742542208e-14 ] [ -1.618198387008e-14 0.0 -1.057436569728e-14 ] [ 1.377871893888e-14 8.8119714144e-15 4.16565921408e-15 ] [ -3.36457090368e-15 4.16565921408e-15 -2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.567729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853354495955016e-18 } }