{ "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" [ 5.46402 0 0 ] "si-unit" "m" "si-value" [ 5.46402e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0122514 5.46447 0 ] "si-unit" "m" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0384841 0.0769758 5.42124 ] "si-unit" "m" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6648731 0.2404273 -0.4964966 ] [ 1.3933428 2.3957529 0.7695833 ] [ 1.6464484 -1.0437062 0.2529086 ] [ -0.5693882 0.1724317 -2.9111284 ] [ -0.1857555 -0.5830907 -0.839994 ] [ 1.9630109 -0.1019873 -1.5391527 ] [ -0.7396969 -1.4012497 3.3220566 ] [ -0.8430885 0.321422 1.4422233 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.269597413395145e-09 3.852070022357082e-10 -7.954752513804444e-10 ] [ 2.232381277312135e-09 3.838419317217739e-09 1.233008381176612e-09 ] [ 2.637901155566685e-09 -1.67220168640093e-09 4.052042494576523e-10 ] [ -9.122604697153187e-10 2.762660407008977e-10 -4.664141901053805e-09 ] [ -2.97613121736987e-10 -9.342142950427036e-10 -1.345818759500196e-09 ] [ 3.14509019626731e-09 -1.634016690247482e-10 -2.465994492098012e-09 ] [ -1.185125089422234e-09 -2.245049527739509e-09 5.322521461345483e-09 ] [ -1.350776695094109e-09 5.14974818053548e-10 2.310696472270372e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.759652 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.729327887437137e-18 } }