{ "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" [ [ 2.38521 1.90546 0.8111876 ] [ 1.820048 1.934055 3.373724 ] [ 3.762919 1.896883 2.504871 ] [ 3.3319 2.668439 4.803022 ] [ 3.103403 4.016922 2.717172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.38521e-10 1.90546e-10 8.111876000000001e-11 ] [ 1.820048e-10 1.934055e-10 3.373724e-10 ] [ 3.762919e-10 1.896883e-10 2.504871e-10 ] [ 3.3319e-10 2.668439e-10 4.803022000000001e-10 ] [ 3.103403e-10 4.016922e-10 2.717172e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7795552 0.4423219 0.0507799 ] [ -3.18496 -0.6776473 -0.2199101 ] [ 3.5073169 -1.2166262 -0.4543103 ] [ 0.6999815 0.6594493 0.7179514 ] [ -0.2427833 0.7925023 -0.0945109 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.248985126353196e-09 7.086778128864845e-10 8.13583692568566e-11 ] [ -5.102868492224638e-09 -1.085710670153188e-09 -3.523348238006034e-10 ] [ 5.619341185213315e-09 -1.949250069952211e-09 -7.2788534724553e-10 ] [ 1.121494003532271e-09 1.056554259767656e-09 1.150284957427588e-09 ] [ -3.889817303854121e-10 1.269728667451258e-09 -1.514231556383106e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.967656 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.07764754409499e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4144875 1.896056 1.3087556 ] [ 1.2685147 2.2346607 3.3447777 ] [ 4.4778753 2.0280668 2.4481852 ] [ 3.3319075 2.3667314 4.4842013 ] [ 2.910695 3.8962441 2.6240567 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4144875e-10 1.896056e-10 1.3087556e-10 ] [ 1.2685147e-10 2.2346607e-10 3.3447777e-10 ] [ 4.4778753e-10 2.0280668e-10 2.4481852e-10 ] [ 3.3319075e-10 2.3667314e-10 4.4842013e-10 ] [ 2.910695e-10 3.8962441e-10 2.6240567e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-07 -1.59e-05 -8.8e-06 ] [ -1.73e-05 8.8e-06 2.31e-05 ] [ 3.15e-05 4.4e-06 -1.04e-05 ] [ -1.64e-05 -1.63e-05 1.6e-06 ] [ 1.5e-06 1.9e-05 -5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.613059803999998e-16 -2.54746084806e-14 -1.40991543792e-14 ] [ -2.77176557682e-14 1.40991543792e-14 3.70102802454e-14 ] [ 5.046856397099999e-14 7.0495771896e-15 -1.66626369936e-14 ] [ -2.62756967976e-14 -2.61154791342e-14 2.5634826144e-15 ] [ 2.403264951e-15 3.0441356046e-14 -8.972189150399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }