{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.4238e-10 0.0 0.0 ] "source-value" [ 5.4238 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] "source-value" [ -0.0012341 5.50722 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] "source-value" [ -0.00966142 -0.113973 5.43239 ] } "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" [ [ 2.458347763423104e-11 -1.654383545988768e-10 1.09751021136745e-10 ] [ -9.003322572575385e-10 4.955806260336557e-10 -6.201875094514445e-10 ] [ 1.931860189068244e-09 4.390151395656634e-10 2.558890274431801e-09 ] [ -2.198497146002035e-10 5.283747781965005e-10 -2.157568422700065e-09 ] [ 2.675240821287283e-10 -4.543255553757944e-09 -7.126177195760447e-11 ] [ 6.31043217363337e-10 7.775595456352416e-10 4.318554929002944e-10 ] [ -6.305414156457024e-10 -7.757530914952897e-11 -7.119701197859175e-10 ] [ -1.104287578691096e-09 2.545739288292951e-09 4.604910354261907e-10 ] ] "source-value" [ [ 0.0153438 -0.1032585 0.0685012 ] [ -0.5619432 0.3093171 -0.3870906 ] [ 1.2057723 0.2740117 1.5971337 ] [ -0.1372194 0.3297856 -1.3466483 ] [ 0.1669754 -2.8356771 -0.0444781 ] [ 0.3938662 0.4853145 0.269543 ] [ -0.393553 -0.0484187 -0.4443768 ] [ -0.6892421 1.5889255 0.2874159 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.85015919444527e-18 "source-value" -36.513822 } }