{ "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" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.1740542 -1.3921879 -3.7993549 ] [ -5.6154931 -4.4817194 7.8498379 ] [ 1.0900104 -2.995552 -1.7277657 ] [ -4.8751555 7.1250185 -10.758035 ] [ 15.5746924 1.7444409 8.4353178 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.89192537628956e-09 -2.230530923517528e-09 -6.087237645053406e-09 ] [ -8.997011833208226e-09 -7.180506102824499e-09 1.257682686406763e-08 ] [ 1.746389193696993e-09 -4.799403420331968e-09 -2.768185833566653e-09 ] [ -7.810860229216586e-09 1.141553815751773e-08 -1.723627230475419e-08 ] [ 2.495340824501738e-08 2.79490244937393e-09 1.351486907952428e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.484804132689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.37891848746203e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3674171 1.0713826 0.6176634 ] [ 1.1377179 1.2292695 2.8667859 ] [ 2.5239352 0.0938935 0.3516471 ] [ 1.6676517 3.059723 0.4367281 ] [ 3.185459 1.8505359 1.8191062 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.674171e-11 1.0713826e-10 6.176634e-11 ] [ 1.1377179e-10 1.2292695e-10 2.8667859e-10 ] [ 2.5239352e-10 9.38935e-12 3.516471e-11 ] [ 1.6676517e-10 3.059723e-10 4.367281e-11 ] [ 3.185459e-10 1.8505359e-10 1.8191062e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.68e-05 2.9e-06 -1.63e-05 ] [ -8.5e-06 -2.11e-05 5.02e-05 ] [ 4.28e-05 -3.28e-05 -1.84e-05 ] [ 3.7e-06 4.12e-05 -3.98e-05 ] [ 3.89e-05 9.9e-06 2.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.230471654912e-13 4.6463122386e-15 -2.61154791342e-14 ] [ -1.3618501389e-14 -3.38059269774e-14 8.04292670268e-14 ] [ 6.857315993519999e-14 -5.255139359519999e-14 -2.94800500656e-14 ] [ 5.9280535458e-15 6.600967732079998e-14 -6.376663003319999e-14 ] [ 6.232467106259999e-14 1.58615486766e-14 3.877267454279999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }