{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8787364 -0.7265056 -0.1598786 ] [ 0.4211849 -0.3374772 0.3702765 ] [ 0.1362548 0.1960928 -0.9079319 ] [ 0.4866221 0.3022659 0.4680233 ] [ 0.8346746 0.5656241 0.2295107 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.010067561525277e-09 -1.16399029679015e-09 -2.561537571966324e-10 ] [ 6.748126053736264e-10 -5.406980843477447e-10 5.93248356419301e-10 ] [ 2.183042568303432e-10 3.141753022556352e-10 -1.454667275443224e-09 ] [ 7.796545582080114e-10 4.842833622349805e-10 7.498559954275721e-10 ] [ 1.337296141113296e-09 9.062297166472792e-10 3.677166807929838e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.613093432689674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.700405031231425e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2059713 2.5604321 3.2338715 ] [ 2.901496 4.3489049 1.8216184 ] [ 4.4994127 2.7056952 1.1709544 ] [ 4.551699 2.2454509 3.5081088 ] [ 4.474404 4.6254119 3.589768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2059713e-10 2.5604321e-10 3.2338715e-10 ] [ 2.901496e-10 4.3489049e-10 1.8216184e-10 ] [ 4.4994127e-10 2.7056952e-10 1.1709544e-10 ] [ 4.551699e-10 2.2454509e-10 3.5081088e-10 ] [ 4.474404e-10 4.6254119e-10 3.589768e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.8e-06 -1.04e-05 9e-07 ] [ 4.6e-06 -8.2e-06 1.75e-05 ] [ 9.6e-06 -1.39e-05 -6.9e-06 ] [ -2.97e-05 3.45e-05 -1.78e-05 ] [ 9.6e-06 -2e-06 6.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.2926244772e-15 -1.66626369936e-14 1.4419589706e-15 ] [ 7.370012516399999e-15 -1.31378483988e-14 2.8038091095e-14 ] [ 1.53808956864e-14 -2.22702552126e-14 -1.10550187746e-14 ] [ -4.75846460298e-14 5.527509387299999e-14 -2.851874408519999e-14 ] [ 1.53808956864e-14 -3.204353268e-15 1.00937127942e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }