{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3611214 -0.6427001 1.7353018 ] [ 1.3033642 -0.2982857 1.1742071 ] [ 0.3998212 -0.6956743 1.5722716 ] [ 1.410939 2.602525 -3.0666786 ] [ -1.6845191 -0.9253699 0.5770828 ] [ -1.1000183 -0.918785 -2.5206349 ] [ 0.0315345 0.87829 0.5284502 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.785802643505651e-10 -1.029719074405822e-09 2.780259973992158e-09 ] [ 2.088219649627695e-09 -4.779063748589625e-10 1.881287163597368e-09 ] [ 6.40584179140201e-10 -1.114593099151405e-09 2.519056799067809e-09 ] [ 2.260573479174931e-09 4.16970471004752e-09 -4.913360756427675e-09 ] [ -2.698897119311058e-09 -1.482606019372034e-09 9.245885704258023e-10 ] [ -1.762423602712161e-09 -1.472055846541728e-09 -4.038502306352546e-09 ] [ 5.05238386486176e-11 1.407175704282432e-09 8.466705556970842e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -27.432157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.395116060351507e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6318439 0.1800761 2.1105381 ] [ 2.6358045 1.3710357 1.8117144 ] [ 2.039235 3.2317562 3.4086251 ] [ 1.4664098 0.9003194 4.1861768 ] [ 3.8578077 0.2481336 3.7127765 ] [ 3.3621253 2.1590811 5.1991829 ] [ 4.4007778 2.5771641 3.0902161 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.318439000000001e-11 1.800761e-11 2.1105381e-10 ] [ 2.6358045e-10 1.3710357e-10 1.8117144e-10 ] [ 2.039235e-10 3.2317562e-10 3.4086251e-10 ] [ 1.4664098e-10 9.003194000000001e-11 4.186176800000001e-10 ] [ 3.8578077e-10 2.481336e-11 3.7127765e-10 ] [ 3.3621253e-10 2.1590811e-10 5.1991829e-10 ] [ 4.4007778e-10 2.5771641e-10 3.0902161e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.07e-05 -2.93e-05 -7.7e-06 ] [ 9.7e-06 4.91e-05 8.58e-05 ] [ 3.5e-06 -1.91e-05 1.2e-05 ] [ -4.61e-05 1.59e-05 5.6e-06 ] [ -2.61e-05 1.49e-05 1.61e-05 ] [ 1.27e-05 -3.44e-05 -9.1e-05 ] [ 1.55e-05 2.9e-06 -2.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.918682225856e-14 -4.694377498944e-14 -1.233675998016e-14 ] [ 1.554111322176e-14 7.866687208128001e-14 1.3746675406464e-13 ] [ 5.6076181728e-15 -3.060157345728e-14 1.92261194496e-14 ] [ -7.386034221888001e-14 2.547460827072e-14 8.972189076479999e-15 ] [ -4.181680980288e-14 2.387243164992e-14 2.579504359488e-14 ] [ 2.034764308416e-14 -5.511487575552001e-14 -1.457980724928e-13 ] [ 2.48337376224e-14 4.646312200320001e-15 -3.332527371264e-14 ] ] } "relaxed-potential-energy" { "source-value" -31.07635 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.978980142979809e-18 } }