{ "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" [ 5.43079 0 0 ] "si-unit" "m" "si-value" [ 5.43079e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0839771 5.43297 0 ] "si-unit" "m" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0398452 0.0785902 5.46584 ] "si-unit" "m" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7717384 1.2821086 -3.454797 ] [ -1.0424745 0.4929454 0.7602175 ] [ -0.5025804 -0.8348118 -2.1151534 ] [ -1.9843605 -1.1235372 4.7482983 ] [ 4.8071553 1.9643072 -2.6214118 ] [ -0.3962733 -2.5056379 -0.2552238 ] [ -0.2923131 1.3442793 -0.1072386 ] [ -2.3608919 -0.6196537 3.0453087 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.838637842653599e-09 2.054164424246619e-09 -5.535194983009978e-09 ] [ -1.67022827168017e-09 7.897855952109043e-10 1.218002705223024e-09 ] [ -8.052225669523124e-10 -1.337515948727965e-09 -3.388849326885631e-09 ] [ -3.179296000338998e-09 -1.800105034439094e-09 7.607612524844385e-09 ] [ 7.701911834214809e-09 3.14716707190911e-09 -4.199964699449246e-09 ] [ -6.348998167072646e-10 -4.014474463570409e-09 -4.08913605431735e-10 ] [ -4.683372147735725e-10 2.153772866285389e-09 -1.718151777673229e-10 ] [ -3.782565806416091e-09 -9.927946711322169e-10 4.879122402258841e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.520635 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.691033095297021e-18 } }