{ "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" [ [ -1.3292499 0.681798 1.0877943 ] [ 1.4145302 0.1324926 -1.5162422 ] [ 1.1185684 1.3845328 -1.5825398 ] [ 0.7256983 0.0032018 -0.7936751 ] [ 0.1015836 1.2460893 0.3828474 ] [ -2.4893197 -3.0168007 0.3972732 ] [ -2.0040568 -2.020096 -0.001016 ] [ 2.462246 1.5887821 2.0255582 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.129693112980738e-09 1.092360815708198e-09 1.742838595699502e-09 ] [ 2.266327215855548e-09 2.122765461490061e-10 -2.429287804310358e-09 ] [ 1.792144139245663e-09 2.218266082890762e-09 -2.535508269045508e-09 ] [ 1.162696850014305e-09 5.12984910447744e-12 -1.271607689731102e-09 ] [ 1.627548689766989e-10 1.996455143889037e-09 6.133891536140659e-10 ] [ -3.988329825036869e-09 -4.833447551153075e-09 6.365018331104026e-10 ] [ -3.210852951715261e-09 -3.236550582971597e-09 -1.6278114467328e-12 ] [ 3.944952975858317e-09 2.545509536165528e-09 3.245301992109731e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -218.18152 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.495653304346077e-17 } }