{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.542623 -4.1820077 -10.1295577 ] [ -18.7905797 -0.8817538 9.4938529 ] [ 10.2218847 -18.8396226 7.9298705 ] [ 7.9963588 10.3219326 -22.5358064 ] [ 7.1149592 13.5814514 15.2416407 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.048243760930836e-08 -6.70031496494558e-09 -1.622934052598462e-08 ] [ -3.010582748661908e-08 -1.412725323661559e-09 1.521082915769428e-08 ] [ 1.637726468685322e-08 -3.018440287441531e-08 1.270505312107161e-08 ] [ 1.281157912088834e-08 1.653755909319336e-08 -3.610634214495501e-08 ] [ 1.139942128818587e-08 2.175988390961143e-08 2.441980039217375e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.434851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.15250041761315e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.141944 1.0963924 0.4463267 ] [ 0.3725595 1.1684397 2.8587823 ] [ 1.6020948 -0.7132459 3.5877437 ] [ 1.6282039 3.0014903 0.2468368 ] [ 1.8574594 3.0746439 2.659353 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.41944e-11 1.0963924e-10 4.463267e-11 ] [ 3.725595e-11 1.1684397e-10 2.8587823e-10 ] [ 1.6020948e-10 -7.132459e-11 3.5877437e-10 ] [ 1.6282039e-10 3.0014903e-10 2.468368e-11 ] [ 1.8574594e-10 3.0746439e-10 2.659353e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.9e-06 1.85e-05 1.5e-06 ] [ 1.75e-05 -1.82e-05 1.29e-05 ] [ -1.11e-05 4.1e-06 -4.1e-06 ] [ -6e-07 -1.23e-05 -1.02e-05 ] [ -1.17e-05 7.8e-06 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.45284206272e-15 2.96402674848e-14 2.4032649312e-15 ] [ 2.8038090864e-14 -2.915961449856e-14 2.066807840832e-14 ] [ -1.778416049088e-14 6.568924145279999e-15 -6.568924145279999e-15 ] [ -9.6130597248e-16 -1.970677243584e-14 -1.634220153216e-14 ] [ -1.874546646336e-14 1.249697764224e-14 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -6.5930512 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.056323249237738e-18 } }