{ "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" [ [ -1.2687992 1.6306749 1.5038827 ] [ 1.5535582 -1.298176 -0.8146905 ] [ 1.436258 4.0171342 -2.6834002 ] [ 1.0070194 -0.9166674 -1.1670733 ] [ 0.2971489 1.8580279 0.5330285 ] [ -2.5541283 -4.5833185 1.4874067 ] [ -3.0554313 -1.8872869 -0.5168402 ] [ 2.5843743 1.1796118 1.6576861 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.032840414729743e-09 2.612629200905378e-09 2.40948570236558e-09 ] [ 2.489074627092131e-09 -2.079907236883661e-09 -1.305278072287862e-09 ] [ 2.301138989036966e-09 6.436158497856111e-09 -4.299281064690044e-09 ] [ 1.613422939372043e-09 -1.468663077329522e-09 -1.869857556019905e-09 ] [ 4.760850204764371e-10 2.97688886217412e-09 8.540058009200928e-10 ] [ -4.092164648783648e-09 -7.343285746380125e-09 2.38308824036128e-09 ] [ -4.895340595320551e-09 -3.023766947922108e-09 -8.280692851295961e-10 ] [ 4.140624082856365e-09 1.889946447579805e-09 2.655905914045131e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.57308 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.699435710584807e-18 } }