{ "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" [ [ 1.593193 1.569284 2.84459 ] [ 1.603337 4.216737 3.188357 ] [ 3.675145 1.205287 1.773064 ] [ 3.545696 2.526378 4.008338 ] [ 3.206595 3.44318 2.117333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593193e-10 1.569284e-10 2.84459e-10 ] [ 1.603337e-10 4.216737e-10 3.188357e-10 ] [ 3.675145e-10 1.205287e-10 1.773064e-10 ] [ 3.545696e-10 2.526378e-10 4.008338e-10 ] [ 3.206595e-10 3.44318e-10 2.117333e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0782444 -1.0920919 0.3020116 ] [ -2.874968 1.3102927 1.1422021 ] [ 0.6271369 -1.3811215 -1.0576894 ] [ 1.6832429 -0.8561607 3.511139 ] [ 2.6428326 2.0190814 -3.8976633 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.329714589988523e-09 -1.749724109945052e-09 4.838759247304013e-10 ] [ -4.606206515148134e-09 2.099320330344908e-09 1.830009500848664e-09 ] [ 1.004784079220987e-09 -2.212800577784227e-09 -1.694605228747979e-09 ] [ 2.696852421507592e-09 -1.371720657187762e-09 5.625464818179091e-09 ] [ 4.234284604408078e-09 3.234925014572133e-09 -6.244745015010176e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.4768618 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.358142979371261e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3816347 1.4411852 3.0775621 ] [ 1.5600018 3.9103797 3.1316816 ] [ 3.4902231 1.3172017 1.78522 ] [ 3.523483 2.5057054 4.0978091 ] [ 3.6686234 3.786394 1.8394091 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3816347e-10 1.4411852e-10 3.077562100000001e-10 ] [ 1.5600018e-10 3.9103797e-10 3.1316816e-10 ] [ 3.4902231e-10 1.3172017e-10 1.78522e-10 ] [ 3.523483e-10 2.5057054e-10 4.0978091e-10 ] [ 3.6686234e-10 3.786394e-10 1.8394091e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.13e-05 2.21e-05 -6.7e-06 ] [ -1.05e-05 -1.46e-05 1.74e-05 ] [ 2.6e-06 6.7e-06 -8e-07 ] [ -9.9e-06 2.2e-06 5e-06 ] [ 6.5e-06 -1.65e-05 -1.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.810459581504e-14 3.540810331968e-14 -1.073458335936e-14 ] [ -1.68228545184e-14 -2.339177866368e-14 2.787787320192e-14 ] [ 4.16565921408e-15 1.073458335936e-14 -1.28174129664e-15 ] [ -1.586154854592e-14 3.52478856576e-15 8.010883104e-15 ] [ 1.04141480352e-14 -2.64359142432e-14 -2.387243164992e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.344766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657414223284673e-18 } }