{ "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" [ [ 0.9066893 0.9379891 0.1369545 ] [ 0.7550462 2.78121 2.963246 ] [ 2.797941 0.0158314 0.1688765 ] [ 2.09203 0.1495358 1.796908 ] [ 2.487588 2.015226 1.460751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.066893000000001e-11 9.379891e-11 1.369545e-11 ] [ 7.550462e-11 2.78121e-10 2.963246e-10 ] [ 2.797941e-10 1.58314e-12 1.688765e-11 ] [ 2.09203e-10 1.495358e-11 1.796908e-10 ] [ 2.487588e-10 2.015226e-10 1.460751e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -26.0795374 5.3645969 -18.9568138 ] [ 1.1456489 0.1915393 -0.6682539 ] [ 27.1716083 -18.9036637 -42.7902253 ] [ -9.0912887 -15.8906967 49.9536897 ] [ 6.8535688 29.2382242 12.4616033 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.17840254478091e-08 8.595031804008834e-09 -3.037216412544874e-08 ] [ 1.835531898347802e-09 3.068797909527162e-10 -1.070660784159373e-09 ] [ 4.353371592646046e-08 -3.028700827713398e-08 -6.855749913925564e-08 ] [ -1.456585032808823e-08 -2.545970295072091e-08 8.003463441942647e-08 ] [ 1.098062779087142e-08 4.684479963289334e-08 1.996568962943729e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.1703 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.78967936547702e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3015948 1.621564 -0.5301078 ] [ 0.3314003 2.7132924 3.0883341 ] [ 2.1293153 -0.7666767 0.0088119 ] [ 3.0543048 0.0363437 2.2845074 ] [ 2.2226793 2.2952689 1.6751905 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3015948e-10 1.621564e-10 -5.301078e-11 ] [ 3.314003e-11 2.7132924e-10 3.0883341e-10 ] [ 2.1293153e-10 -7.666767e-11 8.8119e-13 ] [ 3.0543048e-10 3.63437e-12 2.2845074e-10 ] [ 2.2226793e-10 2.2952689e-10 1.6751905e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.47e-05 -3.9e-06 6e-07 ] [ -4.1e-06 -4.5e-06 1.59e-05 ] [ -7.6e-06 1.14e-05 2.7e-06 ] [ 3.1e-06 -7.6e-06 8.6e-06 ] [ -6.1e-06 4.6e-06 -2.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.35519965198e-14 -6.248488872599999e-15 9.613059803999998e-16 ] [ -6.568924199399999e-15 -7.209794853e-15 2.54746084806e-14 ] [ -1.21765424184e-14 1.82648136276e-14 4.3258769118e-15 ] [ 4.9667475654e-15 -1.21765424184e-14 1.37787190524e-14 ] [ -9.773277467399999e-15 7.370012516399999e-15 -4.438029276179999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }