{ "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" [ [ -0.1350336 -0.0631411 0.4478665 ] [ -1.3853063 1.1553252 -1.4663875 ] [ 2.4648145 -0.2494481 3.1772639 ] [ -0.1767957 0.5024474 -2.7458738 ] [ 0.323527 -5.8536628 -0.0287573 ] [ 1.1922335 1.5481954 0.9568802 ] [ -0.5753746 -0.7183812 -0.678006 ] [ -1.7080648 3.6786652 0.3370139 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.163476787249024e-10 -1.011631950650574e-10 7.17561241451361e-10 ] [ -2.219505384792994e-09 1.851035040111377e-09 -2.349411788889675e-09 ] [ 3.949068199044393e-09 -3.996599172156954e-10 5.090537980631712e-09 ] [ -2.832579395316737e-10 8.050094840940515e-10 -4.399374842272789e-09 ] [ 5.183473998681179e-10 -9.378601761475014e-09 -4.607427411692819e-11 ] [ 1.910168655972039e-09 2.480482494746284e-09 1.533091097977247e-09 ] [ -9.218517399170962e-10 -1.150973572944881e-09 -1.086285370911804e-09 ] [ -2.736621511917883e-09 5.893871427748937e-09 5.399557959132125e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.067968 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.778725556545971e-18 } }