{ "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" [ 5.47435 0 0 ] "si-unit" "m" "si-value" [ 5.474350000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.716605 5.34737 0 ] "si-unit" "m" "si-value" [ -7.16605e-11 5.34737e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.276149 -0.165536 5.69815 ] "si-unit" "m" "si-value" [ -2.76149e-11 -1.65536e-11 5.698150000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.269074 0.0407786 -0.111283 ] [ 1.40941 1.27172 1.01322 ] [ -0.306599 2.71071 2.41068 ] [ 1.07784 4.29368 3.98414 ] [ 2.55814 0.158673 3.18004 ] [ 3.994 1.24784 4.28471 ] [ 2.16355 2.62993 -0.160126 ] [ 3.70597 4.39593 1.80666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.69074e-11 4.07786e-12 -1.11283e-11 ] [ 1.40941e-10 1.27172e-10 1.01322e-10 ] [ -3.06599e-11 2.71071e-10 2.41068e-10 ] [ 1.07784e-10 4.29368e-10 3.98414e-10 ] [ 2.55814e-10 1.58673e-11 3.18004e-10 ] [ 3.994e-10 1.24784e-10 4.28471e-10 ] [ 2.16355e-10 2.62993e-10 -1.60126e-11 ] [ 3.70597e-10 4.39593e-10 1.80666e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9838043 -1.7000403 -2.0939299 ] [ -1.0154639 0.5001987 5.2648993 ] [ 0.7353551 -0.2879888 2.0711627 ] [ -3.7617056 -4.0320227 2.1794323 ] [ 0.855959 0.6675114 -4.5978011 ] [ 1.1039691 2.728095 1.0186561 ] [ 4.8463651 2.9571051 -1.8472699 ] [ -0.7806746 -0.8328584 -1.9951496 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.178404895888726e-09 -2.72376484551835e-09 -3.354845559013956e-09 ] [ -1.626952533250512e-09 8.014066694971757e-10 8.435298638822956e-09 ] [ 1.178168758912733e-09 -4.614089262136991e-10 3.318368483152351e-09 ] [ -6.026916816306949e-09 -6.460012557697591e-09 3.491835506444878e-09 ] [ 1.371397509462006e-09 1.069471168008627e-09 -7.366489490199496e-09 ] [ 1.768753496678009e-09 4.370890064332231e-09 1.632067001501567e-09 ] [ 7.764732923053073e-09 4.737804695502232e-09 -2.959652670471516e-09 ] [ -1.250778602877296e-09 -1.334386267910625e-09 -3.196582070454446e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.686138 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.596026002329949e-18 } }