{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9338146 8.7014094 7.1994899 ] [ -4.4857362 -4.2250496 3.8780099 ] [ 0.831224 0.42730510000000005 -2.7314255 ] [ 8.1160752 -7.5170742 -6.174751 ] [ -6.2222725 -4.3966399 -4.4839015 ] [ 6.4890005 4.8667008 7.3690376 ] [ 1.7503877 3.2190114 -4.4118431 ] [ 2.4551359 -1.0756629 -0.6446164 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.431354900460805e-08 1.394119482354796e-08 1.153485449449899e-08 ] [ -7.18694172592795e-09 -6.769275746611046e-09 6.213256848200676e-09 ] [ 1.331767670420016e-09 6.846182468090335e-10 -4.376226113611766e-09 ] [ 1.300338604522687e-08 -1.204368063928424e-08 -9.893041772968133e-09 ] [ -9.969179609880764e-09 -7.044193715892096e-09 -7.18400221245755e-09 ] [ 1.039652497911432e-08 7.797314306429107e-09 1.180649985778744e-08 ] [ 2.804430273381002e-09 5.157424849659627e-09 -7.068551927694124e-09 ] [ 3.933561372274561e-09 -1.723401964440678e-09 -1.032789333973197e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.800326 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.774538600278268e-18 } }