{ "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" [ 5.34161 0 0 ] "si-unit" "m" "si-value" [ 5.341610000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0977669 5.5284 0 ] "si-unit" "m" "si-value" [ -9.776690000000001e-12 5.5284e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.072801 -0.0524088 5.47046 ] "si-unit" "m" "si-value" [ -7.280100000000001e-12 -5.24088e-12 5.470460000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0796719 -0.127908 0.00668105 ] [ 1.22031 1.46092 1.38882 ] [ -0.251468 2.67688 2.66146 ] [ 1.14494 4.10147 3.98362 ] [ 2.6636 -0.086404 2.79747 ] [ 4.00012 1.38046 4.02333 ] [ 2.71061 2.85329 -0.00699576 ] [ 4.09739 4.08725 1.448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.967190000000001e-12 -1.27908e-11 6.68105e-13 ] [ 1.22031e-10 1.46092e-10 1.38882e-10 ] [ -2.51468e-11 2.67688e-10 2.66146e-10 ] [ 1.14494e-10 4.10147e-10 3.98362e-10 ] [ 2.663600000000001e-10 -8.6404e-12 2.79747e-10 ] [ 4.00012e-10 1.38046e-10 4.02333e-10 ] [ 2.71061e-10 2.85329e-10 -6.99576e-13 ] [ 4.09739e-10 4.08725e-10 1.448e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3170011 2.5154195 -1.2050923 ] [ 1.5198008 -1.917136 -0.8911125 ] [ 4.3390571 -0.0194592 1.1389935 ] [ -0.0890635 -1.1229491 1.7374598 ] [ -0.0918228 1.1991223 -2.26487 ] [ -2.2333243 -1.5881532 2.9147041 ] [ -1.0857459 -0.8293031 -0.4887857 ] [ -4.6759024 1.7624587 -0.941297 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.712244992787883e-09 4.030146314404426e-09 -1.9307707089661e-09 ] [ 2.434989310033137e-09 -3.071590478094029e-09 -1.42771961400264e-09 ] [ 6.951935841936247e-09 -3.117707529947136e-11 1.824868756943165e-09 ] [ -1.426954574666208e-10 -1.799162794368401e-09 2.783717471139844e-09 ] [ -1.471163434163942e-10 1.921205714539924e-09 -3.628721763151296e-09 ] [ -3.578179980124526e-09 -2.544501927288707e-09 4.669870765569905e-09 ] [ -1.739556697109455e-09 -1.328690038376965e-09 -7.831210211213626e-10 ] [ -7.491621506422611e-09 2.823770124265561e-09 -1.508124046629178e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.187317 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.63762966460784e-18 } }