{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.47373 0 0 ] "si-unit" "m" "si-value" [ 5.47373e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.128217 5.8305 0 ] "si-unit" "m" "si-value" [ -1.28217e-11 5.8305e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.28854 -0.0943746 5.99929 ] "si-unit" "m" "si-value" [ 2.8854e-11 -9.437460000000001e-12 5.99929e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.153552 -0.151682 0.285368 ] [ 1.56659 1.11428 1.80298 ] [ 0.0114317 2.78427 2.63644 ] [ 1.58247 4.14354 3.67768 ] [ 2.87662 -0.0580046 2.88139 ] [ 4.22527 1.43863 4.17233 ] [ 2.56962 2.98931 0.105287 ] [ 4.06718 4.1162 1.17836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.53552e-11 -1.51682e-11 2.85368e-11 ] [ 1.56659e-10 1.11428e-10 1.80298e-10 ] [ 1.14317e-12 2.78427e-10 2.63644e-10 ] [ 1.58247e-10 4.14354e-10 3.67768e-10 ] [ 2.87662e-10 -5.800460000000001e-12 2.88139e-10 ] [ 4.22527e-10 1.43863e-10 4.17233e-10 ] [ 2.56962e-10 2.98931e-10 1.05287e-11 ] [ 4.067179999999999e-10 4.1162e-10 1.17836e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5251143 2.7239696 -2.2614652 ] [ -2.7675392 2.4460307 -4.0453608 ] [ -0.1473097 -0.4020012 0.0627781 ] [ -0.3494829 -1.5839248 3.6373967 ] [ 3.2818522 -1.1226811 -0.4322106 ] [ -0.0706033 -0.1265051 2.3207278 ] [ -1.2636842 -2.203721 -2.7837798 ] [ -0.2083473 0.2688328 3.5019139 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.443502475507757e-09 4.364280408889929e-09 -3.623266672192796e-09 ] [ -4.434086603387535e-09 3.918973201299059e-09 -6.481382496460785e-09 ] [ -2.360161573570618e-10 -6.440769241735449e-10 1.005816041182445e-10 ] [ -5.599333317493843e-10 -2.537727283665315e-09 5.827751953315072e-09 ] [ 5.258106867761046e-09 -1.798733411034027e-09 -6.924777185819405e-10 ] [ -1.131189566113286e-10 -2.026835136319661e-10 3.718215824400618e-09 ] [ -2.024645281314351e-09 -3.530750264965997e-09 -4.4601069130153e-09 ] [ -3.338091730668038e-10 4.307176270642022e-10 5.610684578634549e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.200661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.755849691650635e-18 } }