{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.336271 1.731327 1.289714 ] [ 2.769645 4.287083 1.737277 ] [ 4.480326 1.077167 0.108092 ] [ 5.392167 2.307543 2.197028 ] [ 3.12468 2.46702 3.187134 ] [ 4.416093 3.533887 0.3236582 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.336271e-10 1.731327e-10 1.289714e-10 ] [ 2.769645e-10 4.287083e-10 1.737277e-10 ] [ 4.480326e-10 1.077167e-10 1.08092e-11 ] [ 5.392167e-10 2.307543e-10 2.197028e-10 ] [ 3.12468e-10 2.467020000000001e-10 3.187134e-10 ] [ 4.416093e-10 3.533887e-10 3.236582e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3984082 -0.1319052 -4.8331626 ] [ -1.168264 4.1772228 -0.5106655 ] [ -0.7708779 -1.051754 -0.323385 ] [ 1.2841825 -0.6032183 1.5778941 ] [ 1.2158406 -0.8349141 4.4085828 ] [ -2.9592894 -1.5554312 -0.3192639 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.842673576833998e-09 -2.113354293430968e-10 -7.743580186042687e-09 ] [ -1.871765283143376e-09 6.692648765172055e-09 -8.181763318899269e-10 ] [ -1.235082559046988e-09 -1.685095683516036e-09 -5.181198907860899e-10 ] [ 2.057487195291705e-09 -9.66462265461202e-10 2.528065057946459e-09 ] [ 1.94799139998854e-09 -1.337679862417139e-09 7.063328351214294e-09 ] [ -4.741304329923879e-09 -2.49207552443458e-09 -5.115171606597126e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.592979 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.818705987625268e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3678259 1.9391341 0.9684842 ] [ 2.5661445 4.3791125 1.8268524 ] [ 4.5187898 0.908185 0.2584643 ] [ 5.4631436 2.2509153 2.2009793 ] [ 3.2888482 2.4326137 3.2955176 ] [ 4.3144299 3.4940664 0.2926052 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3678259e-10 1.9391341e-10 9.684842e-11 ] [ 2.5661445e-10 4.3791125e-10 1.8268524e-10 ] [ 4.518789800000001e-10 9.08185e-11 2.584643e-11 ] [ 5.4631436e-10 2.2509153e-10 2.2009793e-10 ] [ 3.2888482e-10 2.4326137e-10 3.2955176e-10 ] [ 4.3144299e-10 3.4940664e-10 2.926052e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.89e-05 -6.62e-05 8.55e-05 ] [ 3.55e-05 3.98e-05 9.42e-05 ] [ 0.0001384 -1.81e-05 -2.7e-05 ] [ -8.12e-05 -2.16e-05 -3.49e-05 ] [ -4.74e-05 5.08e-05 -6.09e-05 ] [ 5.37e-05 1.54e-05 -5.7e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.584552691026e-13 -1.060640931708e-13 1.36986102207e-13 ] [ 5.6877270507e-14 6.376663003319999e-14 1.509250389228e-13 ] [ 2.217412461456e-13 -2.899939707539999e-14 -4.325876911799999e-14 ] [ -1.300967426808e-13 -3.46070152944e-14 -5.59159645266e-14 ] [ -7.59431724516e-14 8.13905730072e-14 -9.757255701059999e-14 ] [ 8.603688524579999e-14 2.46735201636e-14 -9.132406813799999e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.321102 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.095581816753067e-18 } }