{ "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" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6083881 -0.3653125 0.9385395 ] [ 0.38275 -0.1178636 -0.2191898 ] [ -0.2660391 -0.1770099 -0.3136969 ] [ -1.4223967 -0.1167125 0.7515298 ] [ 0.1822294 0.4112336 -0.9446476 ] [ 0.7480108 0.6521851 -0.020147 ] [ -0.2329425 -0.2865201 -0.1923879 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.747451901929325e-10 -5.85295146786e-10 1.503706044597322e-09 ] [ 6.132331016112e-10 -1.888383043633229e-10 -3.511807730778278e-10 ] [ -4.262416262386733e-10 -2.83601123430146e-10 -5.025978391974356e-10 ] [ -2.278930738243071e-09 -1.8699403885512e-10 1.2040834753945e-09 ] [ 2.919636843024115e-10 6.588688596074188e-10 -1.51349229961483e-09 ] [ 1.198445415865905e-09 1.04491571965411e-09 -3.227905237925761e-11 ] [ -3.73215027490704e-10 -4.590558056092781e-10 -3.082393955048083e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.91181 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.510658970141165e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4677879 2.050796 2.0236382 ] [ 3.1299173 4.3283277 1.4929047 ] [ 2.2298346 3.7084519 3.6637011 ] [ 5.2616153 3.1789708 1.2877433 ] [ 4.5957559 1.5615006 2.8162393 ] [ 5.0245934 4.8369985 2.9275611 ] [ 4.3565466 3.2303405 4.4665083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4677879e-10 2.050796e-10 2.0236382e-10 ] [ 3.1299173e-10 4.3283277e-10 1.4929047e-10 ] [ 2.2298346e-10 3.7084519e-10 3.6637011e-10 ] [ 5.2616153e-10 3.1789708e-10 1.2877433e-10 ] [ 4.5957559e-10 1.5615006e-10 2.8162393e-10 ] [ 5.0245934e-10 4.8369985e-10 2.9275611e-10 ] [ 4.3565466e-10 3.2303405e-10 4.4665083e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.38e-05 2.79e-05 1.8e-05 ] [ 1.91e-05 -2.16e-05 -4.6e-06 ] [ 1.52e-05 7.5e-06 -2.57e-05 ] [ 3.6e-06 2.8e-05 8e-07 ] [ 1.31e-05 -2.8e-05 -1.09e-05 ] [ -3.92e-05 -8.1e-06 -1.24e-05 ] [ 1.19e-05 -5.7e-06 3.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.813180357504e-14 4.470072772032e-14 2.88391791744e-14 ] [ 3.060157345728e-14 -3.460701500928e-14 -7.370012455680001e-15 ] [ 2.435308463616e-14 1.2016324656e-14 -4.117593915456e-14 ] [ 5.76783583488e-15 4.48609453824e-14 1.28174129664e-15 ] [ 2.098851373248e-14 -4.48609453824e-14 -1.746372516672e-14 ] [ -6.280532353535999e-14 -1.297763062848e-14 -1.986699009792e-14 ] [ 1.906590178752e-14 -9.13240673856e-15 5.559552874176001e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993258982137e-18 } }