{ "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" [ 5.41274 0 0 ] "si-unit" "m" "si-value" [ 5.412740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00162551 5.52562 0 ] "si-unit" "m" "si-value" [ 1.62551e-13 5.52562e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0447781 -0.0207227 5.37358 ] "si-unit" "m" "si-value" [ 4.47781e-12 -2.07227e-12 5.37358e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0391133 0.018955 -0.194937 ] [ 1.34586 1.33293 1.3663 ] [ 0.0913327 2.8499 2.77756 ] [ 1.30939 4.04312 4.06983 ] [ 2.74681 -0.0301059 2.75341 ] [ 4.03842 1.37613 4.21696 ] [ 2.56627 2.70409 -0.0178064 ] [ 4.07687 4.07853 1.33472 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.91133e-12 1.8955e-12 -1.94937e-11 ] [ 1.34586e-10 1.33293e-10 1.3663e-10 ] [ 9.13327e-12 2.8499e-10 2.77756e-10 ] [ 1.30939e-10 4.04312e-10 4.06983e-10 ] [ 2.74681e-10 -3.01059e-12 2.75341e-10 ] [ 4.03842e-10 1.37613e-10 4.21696e-10 ] [ 2.56627e-10 2.70409e-10 -1.78064e-12 ] [ 4.07687e-10 4.07853e-10 1.33472e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8109469 -1.0476924 3.1353905 ] [ -0.7352478 -0.569175 0.3396837 ] [ -2.2635704 -2.6705454 -1.8494509 ] [ 2.3045047 2.0766864 0.2634801 ] [ -0.0633537 -0.2098461 -0.0264502 ] [ -0.4248774 1.0341027 -2.8733102 ] [ 0.5722152 0.8646251 1.573052 ] [ -0.2006176 0.5218449 -0.562395 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.299280174594735e-09 -1.678588282899382e-09 5.023449397565578e-09 ] [ -1.177996845359905e-09 -9.119188856569499e-10 5.442332870906657e-10 ] [ -3.626639604294033e-09 -4.278685439916183e-09 -2.96314701771027e-09 ] [ 3.692223583283179e-09 3.327218426225577e-09 4.221416597439833e-10 ] [ -1.015038178174458e-10 -3.362105181560273e-10 -4.23778924046268e-11 ] [ -6.807286425946715e-10 1.656815183096312e-09 -4.603550464673866e-09 ] [ 9.167898230596368e-10 1.385282132389913e-09 2.520307158466968e-09 ] [ -3.214248310891584e-10 8.360877053520664e-10 -9.010561280784299e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.893503 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.75077318190089e-18 } }