{ "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" [ 5.47373 0 0 ] "si-unit" "m" "si-value" [ 5.47373e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.128217 5.8305 0 ] "si-unit" "m" "si-value" [ -1.28217e-11 5.8305e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.28854 -0.0943746 5.99929 ] "si-unit" "m" "si-value" [ 2.8854e-11 -9.437460000000001e-12 5.99929e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.153552 -0.151682 0.285368 ] [ 1.56659 1.11428 1.80298 ] [ 0.0114317 2.78427 2.63644 ] [ 1.58247 4.14354 3.67768 ] [ 2.87662 -0.0580046 2.88139 ] [ 4.22527 1.43863 4.17233 ] [ 2.56962 2.98931 0.105287 ] [ 4.06718 4.1162 1.17836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.53552e-11 -1.51682e-11 2.85368e-11 ] [ 1.56659e-10 1.11428e-10 1.80298e-10 ] [ 1.14317e-12 2.78427e-10 2.63644e-10 ] [ 1.58247e-10 4.14354e-10 3.67768e-10 ] [ 2.87662e-10 -5.800460000000001e-12 2.88139e-10 ] [ 4.22527e-10 1.43863e-10 4.17233e-10 ] [ 2.56962e-10 2.98931e-10 1.05287e-11 ] [ 4.067179999999999e-10 4.1162e-10 1.17836e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4420873 2.9296238 -0.8703222 ] [ -3.0048752 2.7501911 -4.0403437 ] [ -0.1053982 -0.4672868 -0.0261118 ] [ -0.2146473 -1.8471441 2.2849649 ] [ 3.5176958 -1.1963084 -0.3189827 ] [ -0.4468851 0.2634403 1.6442378 ] [ -0.921451 -2.6418772 -2.363366 ] [ -0.2665262 0.2093613 3.6899236 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.310478557212596e-09 4.693774760099255e-09 -1.394409881403222e-09 ] [ -4.814340793861724e-09 4.406291883152235e-09 -6.473344216136569e-09 ] [ -1.688665319144025e-10 -7.486759861684455e-10 -4.183571548700544e-11 ] [ -3.439028857778438e-10 -2.959451092268658e-09 3.66091734212861e-09 ] [ 5.635969969846353e-09 -1.916697349746655e-09 -5.110666243796602e-10 ] [ -7.1598885940387e-10 4.220778896365383e-10 2.634359362195626e-09 ] [ -1.476327249412781e-09 -4.232753884864566e-09 -3.786529751593613e-09 ] [ -4.270220464706649e-10 3.35433780160295e-10 5.911909324458172e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.563071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.974131836645048e-18 } }