{ "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" [ 5.4207 0 0 ] "si-unit" "m" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.121917 5.37017 0 ] "si-unit" "m" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0328689 -0.300504 5.4102 ] "si-unit" "m" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.11175809999999999 6.813334499999999 -0.9268843999999999 ] [ 0.31919229999999993 -8.330371699999999 -2.5251476999999998 ] [ -1.3835939999999998 4.584200399999999 -0.8749971999999999 ] [ -0.40868019999999994 -1.2562452999999998 1.5985127999999997 ] [ -1.0742016999999997 0.5705222999999999 -2.6401009999999996 ] [ -0.7244599999999999 -1.5849632999999999 7.466220099999999 ] [ 6.583354699999999 4.388809299999999 -4.326006799999999 ] [ -3.1998531999999997 -5.185286099999999 2.2284041999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.790562150050284e-10 1.091616524559006e-08 -1.485032515864235e-09 ] [ 5.114024405993797e-10 -1.334672678031395e-08 -4.045732609006892e-09 ] [ -2.216761959479155e-09 7.344698705942008e-09 -1.401900057105462e-09 ] [ -6.547778618238681e-10 -2.012726849649882e-09 2.561099836209546e-09 ] [ -1.721060849763615e-09 9.140774907050438e-10 -4.2299080987507e-09 ] [ -1.160712874704768e-09 -2.539391144086016e-09 1.196220328996704e-08 ] [ 1.05476969867738e-08 7.031647653609613e-09 -6.93102695638182e-09 ] [ -5.126729987032066e-09 -8.30774416157921e-09 3.570297110932527e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.603217 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.223611204026912e-18 } }