{ "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" [ 5.42631 0 0 ] "si-unit" "m" "si-value" [ 5.42631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0419811 5.40206 0 ] "si-unit" "m" "si-value" [ -4.19811e-12 5.40206e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.291495 -0.184222 5.7849 ] "si-unit" "m" "si-value" [ -2.91495e-11 -1.84222e-11 5.7849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.101951 0.0451697 -0.178669 ] [ 1.35762 1.34832 0.905447 ] [ 0.453616 2.71025 3.0057 ] [ 1.36179 4.05856 4.06079 ] [ 2.63302 -0.145655 3.08939 ] [ 4.07266 1.35506 3.53695 ] [ 2.85903 2.69843 0.171649 ] [ 4.20927 3.69056 1.74197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.01951e-11 4.51697e-12 -1.78669e-11 ] [ 1.35762e-10 1.34832e-10 9.05447e-11 ] [ 4.53616e-11 2.71025e-10 3.0057e-10 ] [ 1.36179e-10 4.05856e-10 4.06079e-10 ] [ 2.63302e-10 -1.45655e-11 3.08939e-10 ] [ 4.07266e-10 1.35506e-10 3.53695e-10 ] [ 2.85903e-10 2.69843e-10 1.71649e-11 ] [ 4.20927e-10 3.69056e-10 1.74197e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1710134 -3.0312315 -3.3165363 ] [ 1.2796954 0.169148 7.7986007 ] [ -1.8241515 -7.2397138 -7.719484 ] [ -0.6474183 0.5596082 12.5738936 ] [ 2.5508961 1.834412 -10.0101046 ] [ 0.7125023 1.192176 8.2060017 ] [ 2.0028696 1.5338193 -6.3236801 ] [ -0.9033801 4.9817817 -1.2086911 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.080523533723519e-09 -4.856568241532516e-09 -5.313676921894535e-09 ] [ 2.050298051625304e-09 2.710049710550784e-10 1.249473571649451e-08 ] [ -2.922612886097251e-09 -1.159930019164313e-08 -1.236797678943967e-08 ] [ -1.037278464138081e-09 8.965911748479706e-10 2.014559835834675e-08 ] [ 4.086986093509899e-09 2.93905201931497e-09 -1.603795556188253e-08 ] [ 1.141554527326228e-09 1.910076515078861e-09 1.314746407398505e-08 ] [ 3.208950847631048e-09 2.457449422991822e-09 -1.013165241363821e-08 ] [ -1.447374475915966e-09 7.981694169669279e-09 -1.936536622189035e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.624313 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.945249859186151e-18 } }