{ "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" [ 5.4238 0 0 ] "si-unit" "m" "si-value" [ 5.4238e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0012341 5.50722 0 ] "si-unit" "m" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00966142 -0.113973 5.43239 ] "si-unit" "m" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3888488 -0.53358 0.0827679 ] [ -0.8260084 0.5149617 -0.3241772 ] [ 1.8883465 0.4669019 2.2160172 ] [ -0.4245496 0.7825383 -1.928463 ] [ 0.4169079 -3.9714668 0.1790947 ] [ -0.0323091 0.7347733 -0.0661998 ] [ -0.343682 0.0276903 -0.517403 ] [ -1.067554 1.9781815 0.3583631 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.23004456386135e-10 -8.548894013264641e-10 1.326087943327123e-10 ] [ -1.323411347064415e-09 8.250595963474233e-10 -5.193891308364058e-10 ] [ 3.025464614269507e-09 7.480593083870995e-10 3.550450949130678e-09 ] [ -6.802034434899917e-10 1.253764569140577e-09 -3.08973833267783e-09 ] [ 6.679600904068244e-10 -6.362991257243389e-09 2.869413412491898e-10 ] [ -5.176488465908928e-11 1.177236602848065e-09 -1.060637718616358e-10 ] [ -5.506392653897856e-10 4.436475128293825e-11 -8.289709901317823e-10 ] [ -1.710410060241523e-09 3.169396150999075e-09 5.741609805774124e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -33.946606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.438845848870901e-18 } }