{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.49393e-10 0.0 0.0 ] "source-value" [ 5.49393 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] "source-value" [ 0.002595 5.45604 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] "source-value" [ -0.0698117 0.0748179 5.57684 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.012503826664267e-09 -1.307618211460203e-09 -4.497780173641466e-09 ] [ -5.502311108956369e-09 -3.748364302309536e-10 5.305099028484435e-09 ] [ 1.67198297551527e-09 7.724812866179538e-10 -4.874344871793278e-09 ] [ -5.296581697350598e-09 5.160121430639146e-09 -1.518856547158931e-09 ] [ 9.613402590596853e-10 -1.892813382425065e-09 3.889089883620883e-09 ] [ -1.946113472722205e-09 -4.563728006400863e-10 5.014719255989345e-09 ] [ 8.20458081005421e-09 -6.146603205450086e-10 -4.854301642267069e-09 ] [ -1.054015922642592e-10 -1.286301411738121e-09 1.536374746330758e-09 ] ] "source-value" [ [ 1.2561061 -0.8161511 -2.8072936 ] [ -3.4342725 -0.2339545 3.3111824 ] [ 1.0435697 0.4821449 -3.0423268 ] [ -3.3058663 3.2206945 -0.9479957 ] [ 0.6000214 -1.1814012 2.427379 ] [ -1.2146685 -0.2848455 3.1299416 ] [ 5.1208966 -0.3836408 -3.0298168 ] [ -0.0657865 -0.8028462 0.9589297 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.185233786775903e-18 "source-value" -32.363684 } }