{ "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" [ [ -2.198745483378259e-10 1.650892403132045e-10 2.351372032628909e-10 ] [ 2.672316848954323e-10 -5.20362933786528e-11 -2.535168928037222e-10 ] [ 3.362532935018343e-10 3.07834205037408e-10 -4.09524194941922e-10 ] [ 1.632028375598746e-10 4.666291342781377e-11 -1.620064922771232e-10 ] [ -3.13017246405696e-12 2.422646461781818e-10 2.635708715345665e-11 ] [ -5.718475977546393e-10 -6.872491753976218e-10 1.663208334816134e-10 ] [ -4.125068069392032e-10 -4.100449023436819e-10 -1.793043921635904e-11 ] [ 4.406713095385843e-10 3.874795263810105e-10 4.151628953411654e-10 ] ] "source-value" [ [ -0.1372349 0.1030406 0.1467611 ] [ 0.1667929 -0.0324785 -0.1582328 ] [ 0.2098728 0.192135 -0.2556049 ] [ 0.1018632 0.0291247 -0.1011165 ] [ -0.0019537 0.1512097 0.0164508 ] [ -0.3569192 -0.4289472 0.1038093 ] [ -0.2574665 -0.2559299 -0.0111913 ] [ 0.2750454 0.2418457 0.2591243 ] ] } "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" 4.915175702103717e-18 "source-value" 30.678114 } }