{ "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" [ [ 0.6226575 -0.9022846 2.9633638 ] [ -0.5923735 -0.3650958 0.2387095 ] [ -2.0929439 -2.4186529 -1.5338438 ] [ 1.9303136 1.7685842 0.2113123 ] [ -0.1806286 -0.1650587 -0.1234738 ] [ -0.1915513 0.8215252 -2.6820745 ] [ 0.707541 0.7685819 1.2853982 ] [ -0.2030149 0.4924007 -0.3593917 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.97607289265776e-10 -1.44561929142788e-09 4.747832199285048e-09 ] [ -9.490869724814689e-10 -5.849479551122727e-10 3.824547800628576e-10 ] [ -3.353265785225973e-09 -3.875109130210121e-09 -2.457488676319031e-09 ] [ 3.092703320732283e-09 2.833584257156272e-09 3.385596267474759e-10 ] [ -2.893989199678349e-10 -2.64453190199641e-10 -1.97826835641335e-10 ] [ -3.068990145438471e-10 1.316228468838044e-09 -4.29715705914385e-09 ] [ 1.133605648457453e-09 1.231403951350043e-09 2.059434944458402e-09 ] [ -3.2526572645405e-10 7.889128896055546e-10 -5.758089794495673e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.963606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.762004873286261e-18 } }