{ "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" [ [ -1.8802948 1.9992475 1.6885274 ] [ 0.9596416 -1.0068302 -0.7374763 ] [ 7.8439527 8.7036805 -7.6866296 ] [ 1.5644194 -1.9068948 -1.6319787 ] [ -0.1290357 0.796141 0.2510281 ] [ -8.1006134 -8.4448428 7.7449616 ] [ -4.9522856 -3.6844203 -3.9173254 ] [ 4.6942158 3.5439191 4.2888929 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.012564368771812e-09 3.203147603692848e-09 2.70531912386021e-09 ] [ 1.537515335867105e-09 -1.613119807555388e-09 -1.181567286254087e-09 ] [ 1.256739763060104e-08 1.394483341201286e-08 -1.231533823786926e-08 ] [ 2.506476187805963e-09 -3.055182266885092e-09 -2.614718118783577e-09 ] [ -2.067379817885626e-10 1.275558497060333e-09 4.021913529838444e-10 ] [ -1.29786134036192e-08 -1.353012970049121e-08 1.240879640451376e-08 ] [ -7.9344362078445e-09 -5.903092065860922e-09 -6.276247171946009e-09 ] [ 7.520962807749969e-09 5.677984328026578e-09 6.871563933495112e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -61.680154 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.882250070614362e-18 } }