{ "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" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -41.074152 -20.4717252 -8.9968379 ] [ -1.4017391 -1.7618186 0.8606139 ] [ -0.6338395 14.1631712 -3.0933849 ] [ -11.1585232 -4.6345656 20.390227 ] [ 41.7728322 6.0104012 5.3126603 ] [ 12.4954216 6.694537 -14.4732784 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.580804659576435e-08 -3.279931977310897e-08 -1.441452346326563e-08 ] [ -2.245833632984189e-09 -2.822744594266592e-09 1.378855481475613e-09 ] [ -1.015522836606243e-09 2.269190195998174e-08 -4.956149006748426e-09 ] [ -1.787792514098691e-08 -7.42539271306019e-09 3.266874526135591e-08 ] [ 6.692745568684281e-08 9.629724363605561e-09 8.511820197039429e-09 ] [ 2.001987251949889e-08 1.072583075684846e-08 -2.31887484698569e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.1256594 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.301874162652246e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3454904 -0.8311783 0.7759732 ] [ -0.054697 0.0366304 2.3816534 ] [ 1.5658143 3.6373836 1.8486812 ] [ 0.0554763 2.2709185 2.9180173 ] [ 2.8559426 0.5352663 -0.2932476 ] [ 2.9660602 2.7695652 0.2430448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3454904e-10 -8.311783000000001e-11 7.759732e-11 ] [ -5.4697e-12 3.663040000000001e-12 2.3816534e-10 ] [ 1.5658143e-10 3.6373836e-10 1.8486812e-10 ] [ 5.54763e-12 2.2709185e-10 2.9180173e-10 ] [ 2.8559426e-10 5.352663e-11 -2.932476e-11 ] [ 2.9660602e-10 2.769565200000001e-10 2.430448e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.26e-05 1.66e-05 -3.21e-05 ] [ -2.42e-05 8.42e-05 3.17e-05 ] [ 6.89e-05 2.8e-05 -4.3e-05 ] [ -3.39e-05 -8.47e-05 -9.8e-06 ] [ -5.6e-05 -7.54e-05 -2.29e-05 ] [ -4.75e-05 3.13e-05 7.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.483615563084e-13 2.65961321244e-14 -5.14298699514e-14 ] [ -3.877267454279999e-14 1.349032725828e-13 5.078899929779999e-14 ] [ 1.103899700826e-13 4.486094575199999e-14 -6.889359526199999e-14 ] [ -5.431378789259999e-14 -1.357043608998e-13 -1.57013310132e-14 ] [ -8.972189150399998e-14 -1.208041182036e-13 -3.66898449186e-14 ] [ -7.6103390115e-14 5.014812864419999e-14 1.219256418474e-13 ] ] } "relaxed-potential-energy" { "source-value" -15.78911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.529694311365574e-18 } }