{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7715073 2.9349441 -2.1876762 ] [ -15.4844801 -7.2085834 3.0333307 ] [ 8.1364952 -0.1574061 0.302511 ] [ 7.5943066 7.4281526 6.6494786 ] [ -0.5910169 -8.1193019 9.6529172 ] [ -1.2566148 -5.4587826 7.0162239 ] [ 0.7021701 5.1814161 -23.9981833 ] [ -0.8723674 5.3995612 -0.468602 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.838267603020428e-09 4.702298859116159e-09 -3.505043690397911e-09 ] [ -2.480887220585798e-08 -1.154942388772027e-08 4.859931570734863e-09 ] [ 1.303610249209316e-08 -2.521923754690674e-10 4.846760557279739e-10 ] [ 1.216742058595198e-08 1.190121252950635e-08 1.065363924120303e-08 ] [ -9.469134674791145e-10 -1.30085557885718e-08 1.54656783877767e-08 ] [ -2.013318870498583e-09 -8.745933931805768e-09 1.124122999149235e-08 ] [ 1.125000527313443e-09 8.301543806451407e-09 -3.844932854170901e-08 ] [ -1.397686664543331e-09 8.651050788493e-09 -7.50783175045668e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.834327 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.658462517251531e-18 } }