{ "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" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.7854125 -2.7397668 2.4809029 ] [ -0.4625553 -1.5498801 0.4196455 ] [ 2.2369031 -6.7923229 1.757746 ] [ 0.8578181 0.4113501 0.798143 ] [ 1.0501413 1.7872267 -1.5562859 ] [ -2.2894078 2.3980902 -3.9501475 ] [ -2.7263401 2.2039691 0.6422939 ] [ -3.4519718 4.2813338 -0.592298 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.667076091551523e-09 -4.38959034956895e-09 3.974844657602838e-09 ] [ -7.410952935928602e-10 -2.483181681721583e-09 6.72346214663247e-10 ] [ 3.583913879342165e-09 -1.088250104096312e-08 2.816219569706964e-09 ] [ 1.374376116042275e-09 6.590555186135634e-10 1.278766065190662e-09 ] [ 1.682511853258384e-09 2.863452858400927e-09 -2.49344490480366e-09 ] [ -3.668035682857345e-09 3.842164084664387e-09 -6.328834025353514e-09 ] [ -4.368078404557223e-09 3.53114779407801e-09 1.029068278740732e-09 ] [ -5.53066855918692e-09 6.859452976714427e-09 -9.489660159649318e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -330.21563 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.290637665675894e-17 } }