{ "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" [ 5.41274 0 0 ] "si-unit" "m" "si-value" [ 5.412740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00162551 5.52562 0 ] "si-unit" "m" "si-value" [ 1.62551e-13 5.52562e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0447781 -0.0207227 5.37358 ] "si-unit" "m" "si-value" [ 4.47781e-12 -2.07227e-12 5.37358e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0391133 0.018955 -0.194937 ] [ 1.34586 1.33293 1.3663 ] [ 0.0913327 2.8499 2.77756 ] [ 1.30939 4.04312 4.06983 ] [ 2.74681 -0.0301059 2.75341 ] [ 4.03842 1.37613 4.21696 ] [ 2.56627 2.70409 -0.0178064 ] [ 4.07687 4.07853 1.33472 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.91133e-12 1.8955e-12 -1.94937e-11 ] [ 1.34586e-10 1.33293e-10 1.3663e-10 ] [ 9.13327e-12 2.8499e-10 2.77756e-10 ] [ 1.30939e-10 4.04312e-10 4.06983e-10 ] [ 2.74681e-10 -3.01059e-12 2.75341e-10 ] [ 4.03842e-10 1.37613e-10 4.21696e-10 ] [ 2.56627e-10 2.70409e-10 -1.78064e-12 ] [ 4.07687e-10 4.07853e-10 1.33472e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6040823 -0.9632975 3.7753601 ] [ -0.5202249 -0.1963246 0.4388747 ] [ -2.4310335 -2.6931792 -1.6269014 ] [ 1.9814976 2.0333213 -0.2784901 ] [ -0.2162632 -0.1344506 -0.3857031 ] [ -0.1176304 0.6139474 -3.4708506 ] [ 0.9394352 0.6187444 1.7350166 ] [ -0.2398631 0.7212389 -0.1873062 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.678465380990918e-10 -1.543372733375088e-09 6.04879368732115e-09 ] [ -8.33492172338018e-10 -3.145466842079117e-10 7.031547838006138e-10 ] [ -3.894945038081596e-09 -4.314948749864847e-09 -2.606583387426789e-09 ] [ 3.17470912889131e-09 3.257739849434663e-09 -4.461903273442541e-10 ] [ -3.464918429793945e-10 -2.154136079725325e-10 -6.179644893900845e-10 ] [ -1.884646767753523e-10 9.83652170680946e-10 -5.560915685609652e-09 ] [ 1.505141114196572e-09 9.913378119309235e-10 2.779803033219905e-09 ] [ -3.843030510126125e-10 1.155552103591509e-09 -3.00097614570889e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.485339 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.685378052696246e-18 } }