{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44188e-10 0.0 0.0 ] "source-value" [ 5.44188 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.812590000000001e-12 5.43851e-10 0.0 ] "source-value" [ -0.0681259 5.43851 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.52152e-13 -1.7859e-12 5.5414e-10 ] "source-value" [ -0.00252152 -0.017859 5.5414 ] } "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" [ [ -4.000719937498502e-10 3.75325895188608e-12 -2.729650098459003e-09 ] [ 6.486005096447116e-10 6.854063518483776e-11 2.317071033354202e-10 ] [ -1.369329088145894e-10 2.993372856337221e-09 -4.690101770196071e-09 ] [ -6.528760781749786e-10 -2.216097056181523e-10 4.915063709957923e-09 ] [ 1.014039052471039e-09 -4.676240859596544e-11 -3.325213755425372e-09 ] [ -1.2555056544744e-09 -2.382978010609769e-09 6.190330130220283e-09 ] [ -6.598439442988377e-10 -6.714930500733504e-11 -2.22645240433474e-09 ] [ 1.442591177614568e-09 -3.471671604250618e-10 1.634317084901559e-09 ] ] "source-value" [ [ -0.2497053 0.0023426 -1.7037136 ] [ 0.4048246 0.0427797 0.1446202 ] [ -0.0854668 1.8683164 -2.9273313 ] [ -0.4074932 -0.1383179 3.0677415 ] [ 0.6329134 -0.0291868 -2.0754352 ] [ -0.783625 -1.4873379 3.8637002 ] [ -0.4118422 -0.0419113 -1.3896423 ] [ 0.9003946 -0.2166847 1.0200605 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.31502e-13 -1.37584e-12 3.07734e-12 ] [ 1.33409e-10 1.32426e-10 1.37744e-10 ] [ 3.962240000000001e-12 2.60036e-10 2.83022e-10 ] [ 1.35045e-10 4.04355e-10 3.98016e-10 ] [ 2.67673e-10 1.3858e-12 2.80413e-10 ] [ 4.08887e-10 1.41719e-10 3.918e-10 ] [ 2.72143e-10 2.70354e-10 1.7408e-12 ] [ 3.9766e-10 4.077740000000001e-10 1.36794e-10 ] ] "source-value" [ [ 0.00431502 -0.0137584 0.0307734 ] [ 1.33409 1.32426 1.37744 ] [ 0.0396224 2.60036 2.83022 ] [ 1.35045 4.04355 3.98016 ] [ 2.67673 0.013858 2.80413 ] [ 4.08887 1.41719 3.918 ] [ 2.72143 2.70354 0.017408 ] [ 3.9766 4.07774 1.36794 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.234185589892913e-18 "source-value" -26.427708 } }