{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.448400000000001e-10 0.0 0.0 ] "source-value" [ 5.4484 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.76084e-13 5.4399e-10 0.0 ] "source-value" [ 0.00476084 5.4399 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.970310000000001e-12 -6.39637e-12 5.39979e-10 ] "source-value" [ -0.0697031 -0.0639637 5.39979 ] } "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" [ [ -1.672634580746949e-09 2.087628126019296e-09 2.13755547431199e-09 ] [ 1.90083083445321e-09 -1.633831304950132e-09 -9.640847876111155e-10 ] [ 2.694822143293715e-09 5.971992870350115e-09 -4.278275567885383e-09 ] [ 1.37611030069343e-09 -1.225483908736188e-09 -1.745293130282567e-09 ] [ 4.526280332242906e-10 2.102853129793772e-09 7.122841464035943e-10 ] [ -4.0416337605579e-09 -6.450391914519974e-09 2.878148639646161e-09 ] [ -4.392427928417128e-09 -3.068644716159026e-09 -1.270796828143315e-09 ] [ 3.68230479783967e-09 2.215877718202136e-09 2.530462213778298e-09 ] ] "source-value" [ [ -1.0439764 1.302995 1.3341572 ] [ 1.1864053 -1.0197573 -0.6017344 ] [ 1.6819757 3.7274248 -2.6702896 ] [ 0.8589005 -0.7648869 -1.0893263 ] [ 0.2825082 1.3124977 0.4445728 ] [ -2.5225894 -4.026018 1.7963991 ] [ -2.7415379 -1.9152974 -0.793169 ] [ 2.2983139 1.3830421 1.5793903 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.02537e-13 -3.03023e-12 -4.91559e-12 ] [ 1.28054e-10 1.44048e-10 1.35481e-10 ] [ -5.35965e-12 2.57981e-10 2.82719e-10 ] [ 1.28029e-10 4.0563e-10 4.12138e-10 ] [ 2.62772e-10 -7.771450000000001e-12 2.68834e-10 ] [ 4.08246e-10 1.48548e-10 4.03991e-10 ] [ 2.84369e-10 2.84518e-10 1.89163e-12 ] [ 4.03071e-10 4.03913e-10 1.36727e-10 ] ] "source-value" [ [ -0.00902537 -0.0303023 -0.0491559 ] [ 1.28054 1.44048 1.35481 ] [ -0.0535965 2.57981 2.82719 ] [ 1.28029 4.0563 4.12138 ] [ 2.62772 -0.0777145 2.68834 ] [ 4.08246 1.48548 4.03991 ] [ 2.84369 2.84518 0.0189163 ] [ 4.03071 4.03913 1.36727 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.726222821943285e-18 "source-value" -35.740272 } }