{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.412740000000001e-10 0.0 0.0 ] "source-value" [ 5.41274 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.62551e-13 5.52562e-10 0.0 ] "source-value" [ 0.00162551 5.52562 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.47781e-12 -2.07227e-12 5.37358e-10 ] "source-value" [ 0.0447781 -0.0207227 5.37358 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.685709623713974e-09 -2.088743080729711e-09 6.822086957050526e-09 ] [ -1.28162962492953e-09 -4.902376874386119e-10 5.797879850873243e-10 ] [ -4.680696512778988e-09 -5.559499041041542e-09 -3.492722282435984e-09 ] [ 4.253878102956828e-09 3.798460039365076e-09 1.803855409473062e-10 ] [ -5.400830042883206e-10 -3.204729753105888e-10 -1.278666719704685e-10 ] [ -6.837388064214489e-10 1.889440800638281e-09 -6.460501809214885e-09 ] [ 1.448913366560245e-09 1.443105476309844e-09 3.131275402442719e-09 ] [ -2.02352984595095e-10 1.327946307989589e-09 -6.32445121906537e-10 ] ] "source-value" [ [ 1.0521372 -1.3036909 4.2580118 ] [ -0.7999303 -0.3059823 0.3618752 ] [ -2.921461 -3.4699664 -2.1799858 ] [ 2.6550619 2.3708123 0.1125878 ] [ -0.3370933 -0.2000235 -0.0798081 ] [ -0.4267562 1.1792962 -4.0323281 ] [ 0.9043406 0.9007156 1.9543884 ] [ -0.1262988 0.8288389 -0.3947412 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.688471375098025e-18 "source-value" -35.504646 } }