{ "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" [ [ 0.2422976 0.2155702 0.7539187 ] [ 0.1069263 2.303076 0.5134626 ] [ 0.4438839 2.233015 2.726304 ] [ 2.36111 0.1695128 0.2725886 ] [ 2.483594 1.001172 2.982027 ] [ 2.63043 2.516837 1.068712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.422976e-11 2.155702e-11 7.539187e-11 ] [ 1.069263e-11 2.303076e-10 5.134626e-11 ] [ 4.438839e-11 2.233015e-10 2.726304e-10 ] [ 2.36111e-10 1.695128e-11 2.725886e-11 ] [ 2.483594e-10 1.001172e-10 2.982027e-10 ] [ 2.63043e-10 2.516837e-10 1.068712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4662809 -5.8630138 -0.3846676 ] [ -1.2479128 5.3051076 -2.2785891 ] [ -0.9180435 0.8366986 3.7718824 ] [ 2.9092529 -0.00482 1.1126782 ] [ 0.3169115 -0.7326704 -0.791043 ] [ 1.4060728 0.458698 -1.430261 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.951417598305583e-09 -9.393583637787767e-09 -6.16305435499246e-10 ] [ -1.999376712957066e-09 8.4997193675484e-09 -3.650702184429713e-09 ] [ -1.470867832577405e-09 1.340538935576091e-09 6.043221797686994e-09 ] [ 4.6611369803746e-09 -7.722491312256e-12 1.782706998513827e-09 ] [ 5.077481961626592e-10 -1.173867385632184e-09 -1.267390600647494e-09 ] [ 2.252776967302794e-09 7.349152116077184e-10 -2.291530735842029e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.78445 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.888077027898656e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1829256 0.1591278 0.0008289 ] [ 0.1199911 2.3984554 0.8253363 ] [ 0.3909753 2.2265704 3.1907921 ] [ 2.4281145 -0.0882304 0.7710088 ] [ 2.5669049 1.2909403 2.8990014 ] [ 2.5793305 2.4523196 0.6300455 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.829256e-11 1.591278e-11 8.289e-14 ] [ 1.199911e-11 2.3984554e-10 8.253363e-11 ] [ 3.909753e-11 2.2265704e-10 3.1907921e-10 ] [ 2.4281145e-10 -8.82304e-12 7.710088e-11 ] [ 2.5669049e-10 1.2909403e-10 2.8990014e-10 ] [ 2.5793305e-10 2.4523196e-10 6.300455e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.12e-05 -1.2e-06 -3.7e-06 ] [ -1.9e-06 3.1e-06 -2.4e-06 ] [ -2.68e-05 1.89e-05 1.95e-05 ] [ 1.1e-06 7.4e-06 -5.2e-06 ] [ 2.15e-05 -1.36e-05 -2.3e-06 ] [ -5.1e-06 -1.47e-05 -5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.794437815296e-14 -1.92261194496e-15 -5.928053496960001e-15 ] [ -3.04413557952e-15 4.96674752448e-15 -3.84522388992e-15 ] [ -4.293833343744e-14 3.028113813312e-14 3.12424441056e-14 ] [ 1.76239428288e-15 1.185610699392e-14 -8.33131842816e-15 ] [ 3.44467973472e-14 -2.178960204288e-14 -3.68500622784e-15 ] [ -8.17110076608e-15 -2.355199632576e-14 -9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.527678 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.32759060461105e-18 } }