{ "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" [ 5.41852 0 0 ] "si-unit" "m" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038783 5.47951 0 ] "si-unit" "m" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00323821 0.0198894 5.39896 ] "si-unit" "m" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0136142 -0.0297439 -0.141562 ] [ 1.34075 1.30471 1.3715 ] [ -0.0280615 2.73239 2.73273 ] [ 1.33689 4.08129 3.93514 ] [ 2.80172 0.157681 2.72105 ] [ 4.07194 1.39009 4.01929 ] [ 2.65272 2.79754 0.0144035 ] [ 4.02421 4.07244 1.32124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.36142e-12 -2.97439e-12 -1.41562e-11 ] [ 1.34075e-10 1.30471e-10 1.3715e-10 ] [ -2.80615e-12 2.73239e-10 2.73273e-10 ] [ 1.33689e-10 4.08129e-10 3.93514e-10 ] [ 2.80172e-10 1.57681e-11 2.72105e-10 ] [ 4.07194e-10 1.39009e-10 4.01929e-10 ] [ 2.65272e-10 2.79754e-10 1.44035e-12 ] [ 4.02421e-10 4.072440000000001e-10 1.32124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.094343 -0.3187371 1.287857 ] [ -0.3584789 0.8772669 -0.6206766 ] [ 0.0273188 -0.2964695 -1.2295963 ] [ 0.9396941 0.9770441 0.4599786 ] [ -1.2125682 -2.20212 -0.7731557 ] [ -0.051857 1.0703741 1.1524145 ] [ -0.0631257 -1.1325846 -0.4748989 ] [ 0.8133599 1.0252261 0.1980775 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.511541489361344e-10 -5.106731298015917e-10 2.063374376333625e-09 ] [ -5.743465126301012e-10 1.405536517381691e-09 -9.944335375976333e-10 ] [ 4.376954266831105e-11 -4.749965016802657e-10 -1.970030444882183e-09 ] [ 1.505555917723697e-09 1.565397214510577e-09 7.36966958988315e-10 ] [ -1.942748421165539e-09 -3.528185180196096e-09 -1.238731986778259e-09 ] [ -8.308407302482561e-11 1.714928358529841e-09 1.846371569370921e-09 ] [ -1.011385207116346e-10 -1.81460056719812e-09 -7.608719148236371e-10 ] [ 1.303146216076226e-09 1.642593288453963e-09 3.17355139606512e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -23.389365 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.747389377835779e-18 } }