{ "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" [ 5.48715 0 0 ] "si-unit" "m" "si-value" [ 5.48715e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0853536 5.45185 0 ] "si-unit" "m" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0925937 0.0373061 5.50955 ] "si-unit" "m" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.108625 -0.0346204 -0.093953 ] [ 1.31877 1.39109 1.34024 ] [ -0.0198257 2.75858 2.57664 ] [ 1.43337 4.133 3.94558 ] [ 2.6449 -0.0446732 2.70542 ] [ 4.12571 1.36749 4.0773 ] [ 2.7517 2.72879 0.0316261 ] [ 4.07324 4.11206 1.36119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08625e-11 -3.46204e-12 -9.3953e-12 ] [ 1.31877e-10 1.39109e-10 1.34024e-10 ] [ -1.98257e-12 2.75858e-10 2.57664e-10 ] [ 1.43337e-10 4.133e-10 3.94558e-10 ] [ 2.6449e-10 -4.467320000000001e-12 2.70542e-10 ] [ 4.12571e-10 1.36749e-10 4.0773e-10 ] [ 2.7517e-10 2.72879e-10 3.16261e-12 ] [ 4.07324e-10 4.11206e-10 1.36119e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9625423 -0.2751149 0.3852674 ] [ 0.7995978 -0.6665438 -0.5469784 ] [ -0.1068345 -0.06615 1.8391717 ] [ -1.4065373 -1.5095013 1.6566939 ] [ 1.2558837 2.0270294 -0.4923125 ] [ -0.7607678 0.41348 -0.2606448 ] [ 0.2781974 -0.3094809 -1.342392 ] [ 0.903003 0.3862815 -1.2388053 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.54216276959106e-09 -4.407826608137299e-10 6.172664210364019e-10 ] [ 1.281096901203114e-09 -1.067920893099191e-09 -8.763560045625908e-10 ] [ -1.711677381948576e-10 -1.0598398346592e-10 2.946677899376991e-09 ] [ -2.253521178343156e-09 -2.418487691927207e-09 2.654316234401974e-09 ] [ 2.012147502583801e-09 3.247659114354252e-09 -7.887715776276e-10 ] [ -1.21888438301745e-09 6.624679891683841e-10 -4.175990048930918e-10 ] [ 4.457213702473459e-10 -4.958430625641427e-10 -2.150749078348954e-09 ] [ 1.446770295112262e-09 6.188911883475552e-10 -1.98478488938313e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.375993 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.828076554298446e-18 } }