{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3337938999999999 0.4014218999999999 -0.8511411999999998 ] [ -0.007656299999999996 -0.10812389999999997 -0.8918181999999998 ] [ -0.4145102999999999 0.7431799999999998 0.07034239999999999 ] [ 0.19202299999999994 -0.19750129999999994 0.14636569999999996 ] [ -0.4756703999999999 -0.21885989999999994 0.09115529999999998 ] [ 0.7974381999999998 0.09092349999999999 0.20568369999999994 ] [ -1.2170481999999998 -0.49473859999999986 -0.22441589999999995 ] [ 0.7916300999999998 -0.21630159999999996 1.4538282999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.34796782745653e-10 6.431487832571153e-10 -1.363678531639657e-09 ] [ -1.226674486183103e-11 -1.732335847297171e-10 -1.428850270043938e-09 ] [ -6.641187117407941e-10 1.190705621046144e-09 1.127009487309619e-10 ] [ 3.076547612558783e-10 -3.16431965437607e-10 2.345037026270265e-10 ] [ -7.621079940865842e-10 -3.506522150106258e-10 1.460468905220102e-10 ] [ 1.277636840572834e-09 1.456755059813088e-10 3.295416154196409e-10 ] [ -1.949926172426722e-09 -7.926586183273226e-10 -3.595539083157906e-10 ] [ 1.268331238541566e-09 -3.465533665616332e-10 2.329289712917408e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 645.83723 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.034745310748232e-16 } }