{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.33408e-10 0.0 0.0 ] "source-value" [ 5.33408 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.4982e-12 5.437299999999999e-10 0.0 ] "source-value" [ 0.034982 5.4373 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.79208e-11 1.85424e-11 5.40079e-10 ] "source-value" [ 0.179208 0.185424 5.40079 ] } "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" [ [ 3.880553807020585e-09 8.489272214674811e-10 -6.212215542425088e-11 ] [ -7.927789417915451e-10 5.965711056255284e-10 -1.973739003106349e-09 ] [ 1.606816043640851e-09 1.798115932164371e-09 -5.807662741319847e-10 ] [ -4.954454183486263e-09 4.847589163096566e-09 -6.600120286481259e-09 ] [ -1.866665379320623e-09 7.594426130602214e-10 4.524343140490696e-09 ] [ -1.967833219864418e-09 -1.56676851748032e-12 -9.25353129109248e-10 ] [ 3.102597562454033e-09 -5.159532951166325e-09 4.59846415684578e-09 ] [ 9.917641511297186e-10 -3.689546315730361e-09 1.019293550916615e-09 ] ] "source-value" [ [ 2.4220512 0.5298587 -0.0387736 ] [ -0.4948137 0.3723504 -1.231911 ] [ 1.0028957 1.1222957 -0.3624858 ] [ -3.0923271 3.0256272 -4.1194711 ] [ -1.1650809 0.4740068 2.8238729 ] [ -1.2282249 -0.0009779 -0.57756 ] [ 1.9364891 -3.2203272 2.8701356 ] [ 0.6190105 -2.3028337 0.636193 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -4.92126e-12 -4.209990000000001e-12 -4.77888e-12 ] [ 1.41891e-10 1.35069e-10 1.31795e-10 ] [ 6.00152e-12 2.70621e-10 2.67075e-10 ] [ 1.52388e-10 3.98641e-10 4.19062e-10 ] [ 2.7955e-10 -3.17733e-12 2.51171e-10 ] [ 4.14719e-10 1.34284e-10 3.96242e-10 ] [ 2.77343e-10 2.76788e-10 -1.81612e-11 ] [ 4.04692e-10 4.12597e-10 1.21449e-10 ] ] "source-value" [ [ -0.0492126 -0.0420999 -0.0477888 ] [ 1.41891 1.35069 1.31795 ] [ 0.0600152 2.70621 2.67075 ] [ 1.52388 3.98641 4.19062 ] [ 2.7955 -0.0317733 2.51171 ] [ 4.14719 1.34284 3.96242 ] [ 2.77343 2.76788 -0.181612 ] [ 4.04692 4.12597 1.21449 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.647729465590039e-18 "source-value" -35.250355 } }