{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9892729999999997 2.8869207999999995 -1.3197360999999999 ] [ 0.5705166999999999 -1.1696717999999997 -0.9106495999999997 ] [ -1.2712520999999999 2.7725155999999997 -0.10226719999999997 ] [ -0.04815539999999999 -1.6585581999999996 0.5258686999999999 ] [ -0.6995291999999999 0.3509460999999999 -0.16296429999999998 ] [ 1.4968798999999997 -1.6605705999999996 0.5839381999999999 ] [ -2.5478467999999994 0.2927816999999999 -1.2690639999999997 ] [ 1.5101139999999995 -1.8143635999999996 2.6548743999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.584990072188678e-09 4.625357011861232e-09 -2.114450325045771e-09 ] [ 9.140685185159672e-10 -1.874020811969053e-09 -1.459021498860871e-09 ] [ -2.036770393762904e-09 4.442059675123284e-09 -1.638501169146777e-10 ] [ -7.71534560452723e-11 -2.65730317227613e-09 8.425345367504888e-10 ] [ -1.120769329806927e-09 5.622776365809389e-10 -2.610975914850374e-10 ] [ 2.398265979925441e-09 -2.660527392507828e-09 9.355721320320344e-10 ] [ -4.082100576340092e-09 4.690879947380792e-10 -2.033264671098931e-09 ] [ 2.41946934554277e-09 -2.906930941550522e-09 4.253577694840428e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.149006 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.791709227835893e-18 } }