{ "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" [ [ 1.2638583 1.8557593 -1.4672785 ] [ 1.7638908 -1.5947087 1.4417901 ] [ -1.2992451 0.3673888 4.6214455 ] [ 0.2295002 1.7215154 -2.679214 ] [ -1.9580042 -2.3499549 -1.9167431 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.024924236946962e-09 2.973254188788196e-09 -2.350839328270569e-09 ] [ 2.826064624687567e-09 -2.555005017176515e-09 2.310002409352523e-09 ] [ -2.081620141058993e-09 5.886217509532992e-10 7.404371995404446e-09 ] [ 3.676998579383267e-10 2.758171748951163e-09 -4.292574068285675e-09 ] [ -3.137068578513862e-09 -3.765042831733806e-09 -3.070961008200725e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.755893 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.005025351440416e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5517379 2.744385 3.0900469 ] [ 2.74841 4.5630087 1.6077075 ] [ 4.3348887 2.8247914 1.5363762 ] [ 4.7047799 2.0313418 3.7220176 ] [ 4.2931664 4.3223681 3.3681728 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5517379e-10 2.744385e-10 3.0900469e-10 ] [ 2.74841e-10 4.5630087e-10 1.6077075e-10 ] [ 4.3348887e-10 2.8247914e-10 1.5363762e-10 ] [ 4.704779900000001e-10 2.0313418e-10 3.7220176e-10 ] [ 4.2931664e-10 4.322368100000001e-10 3.3681728e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.17e-05 -9.1e-06 -2.22e-05 ] [ -1.33e-05 4.28e-05 -1.3e-05 ] [ -2.48e-05 -1.63e-05 2.95e-05 ] [ 1.04e-05 2.72e-05 9.2e-06 ] [ -4e-06 -4.46e-05 -3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.078899929779999e-14 -1.45798073694e-14 -3.55683212748e-14 ] [ -2.13089492322e-14 6.857315993519999e-14 -2.082829624199999e-14 ] [ -3.97339805232e-14 -2.61154791342e-14 4.726421070299999e-14 ] [ 1.66626369936e-14 4.35792044448e-14 1.47400250328e-14 ] [ -6.408706535999999e-15 -7.145707787639999e-14 -5.607618218999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245508681305e-18 } }