{ "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" [ 5.4484 0 0 ] "si-unit" "m" "si-value" [ 5.448400000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00476084 5.4399 0 ] "si-unit" "m" "si-value" [ 4.76084e-13 5.4399e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0697031 -0.0639637 5.39979 ] "si-unit" "m" "si-value" [ -6.970310000000001e-12 -6.39637e-12 5.39979e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7641912 1.1142099 1.018861 ] [ 1.0182831 -1.0155263 -0.4458577 ] [ 0.8674981 2.6856033 -1.744509 ] [ 0.6719425 -0.5686176 -0.7704469 ] [ 0.1853774 1.2505744 0.3128576 ] [ -1.5658493 -3.0392617 0.9249819 ] [ -1.9944065 -1.1702024 -0.2784899 ] [ 1.581346 0.7432203 0.982603 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.224369274461097e-09 1.785161052443906e-09 1.632395274044909e-09 ] [ 1.631469376175749e-09 -1.627052495667527e-09 -7.143427831436602e-10 ] [ 1.389885174408421e-09 4.302810820003329e-09 -2.795011534575188e-09 ] [ 1.076570564021904e-09 -9.11025824895406e-10 -1.234392010747836e-09 ] [ 2.9700733630469e-10 2.003641066250988e-09 5.012531323595981e-10 ] [ -2.508767140156046e-09 -4.869434040232863e-09 1.481984374843163e-09 ] [ -3.195391466671555e-09 -1.87487092688405e-09 -4.461900069089299e-10 ] [ 2.533595590595597e-09 1.190770188763962e-09 1.574303554127942e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.740422 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.483199585472598e-18 } }