{ "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" [ [ -0.9388177 1.2419751 1.2579153 ] [ 1.1343655 -1.0305921 -0.6035349 ] [ 0.9345654 2.8932591 -1.8651601 ] [ 0.7717425 -0.580438 -0.9971608 ] [ 0.3324285 1.2924004 0.4172785 ] [ -1.7134131 -3.3163143 0.9808553 ] [ -2.3930504 -1.6533613 -0.4207358 ] [ 1.8721793 1.153071 1.2305425 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.504151782525622e-09 1.989863485229813e-09 2.0154025012111e-09 ] [ 1.817453898515727e-09 -1.651190581804991e-09 -9.669695145835264e-10 ] [ 1.497338846824863e-09 4.635512126127869e-09 -2.988315930889103e-09 ] [ 1.236467800964745e-09 -9.29964201085692e-10 -1.597627734100747e-09 ] [ 5.32609175175669e-10 2.070653722652253e-09 6.685538625705689e-10 ] [ -2.745190433209505e-09 -5.313321282460066e-09 1.57150344299506e-09 ] [ -3.834089434864354e-09 -2.648976842419864e-09 -6.740930678472971e-10 ] [ 2.999561929118476e-09 1.847423413543014e-09 1.971546440643945e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.862352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.745782241468316e-18 } }