{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.41643e-10 0.0 0.0 ] "source-value" [ 5.41643 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.84288e-12 5.39313e-10 0.0 ] "source-value" [ 0.0584288 5.39313 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.47548e-12 2.03328e-11 5.3475e-10 ] "source-value" [ -0.0447548 0.203328 5.3475 ] } "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" [ [ 3.894572051364274e-09 -4.049595456839641e-09 5.219706058731374e-09 ] [ -2.508838757450995e-09 1.560345551625195e-09 -9.687109123860134e-10 ] [ 7.020821265529881e-10 5.268025622785094e-10 1.817078653777511e-09 ] [ -2.857332039465093e-09 8.520006768791617e-10 -4.293242941659236e-09 ] [ 6.858440665011802e-10 6.252942872125825e-10 2.763735124325226e-09 ] [ -4.305300602472052e-09 3.845119267786662e-09 -4.8248640501248e-09 ] [ 2.306820948204972e-09 -2.617654267658855e-09 8.862065068625933e-10 ] [ 2.082152206764726e-09 -7.42312621283614e-10 -5.999085997443167e-10 ] ] "source-value" [ [ 2.4308007 -2.5275587 3.2578843 ] [ -1.565894 0.9738911 -0.6046218 ] [ 0.4382052 0.3288043 1.1341313 ] [ -1.7834064 0.531777 -2.6796315 ] [ 0.4280702 0.390278 1.7249878 ] [ -2.6871573 2.3999347 -3.0114433 ] [ 1.4398044 -1.6338113 0.5531266 ] [ 1.2995772 -0.4633151 -0.3744335 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.33581e-12 2.77146e-12 -1.24532e-11 ] [ 1.5025e-10 1.22494e-10 1.34546e-10 ] [ 4.58685e-12 2.70233e-10 2.56072e-10 ] [ 1.46199e-10 4.10879e-10 4.17844e-10 ] [ 2.74075e-10 -3.40431e-12 2.6907e-10 ] [ 4.13695e-10 1.41216e-10 4.09761e-10 ] [ 2.75898e-10 2.67415e-10 5.40851e-12 ] [ 4.02257e-10 4.13506e-10 1.27654e-10 ] ] "source-value" [ [ 0.0133581 0.0277146 -0.124532 ] [ 1.5025 1.22494 1.34546 ] [ 0.0458685 2.70233 2.56072 ] [ 1.46199 4.10879 4.17844 ] [ 2.74075 -0.0340431 2.6907 ] [ 4.13695 1.41216 4.09761 ] [ 2.75898 2.67415 0.0540851 ] [ 4.02257 4.13506 1.27654 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.695619646309385e-18 "source-value" -35.549262 } }