{ "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" [ 5.41394 0 0 ] "si-unit" "m" "si-value" [ 5.413940000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0321649 5.43167 0 ] "si-unit" "m" "si-value" [ 3.216490000000001e-12 5.431670000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.034689 -0.0250046 5.52467 ] "si-unit" "m" "si-value" [ -3.4689e-12 -2.50046e-12 5.52467e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0104706 0.0216981 0.0176006 ] [ 1.39448 1.38403 1.49781 ] [ 0.0179868 2.6904 2.7801 ] [ 1.33759 4.02716 4.17727 ] [ 2.6683 -0.0231463 2.83015 ] [ 4.02805 1.42643 4.22871 ] [ 2.71964 2.8128 -0.0574889 ] [ 4.09713 4.0529 1.34951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04706e-12 2.16981e-12 1.76006e-12 ] [ 1.39448e-10 1.38403e-10 1.49781e-10 ] [ 1.79868e-12 2.6904e-10 2.7801e-10 ] [ 1.33759e-10 4.02716e-10 4.17727e-10 ] [ 2.6683e-10 -2.31463e-12 2.83015e-10 ] [ 4.02805e-10 1.42643e-10 4.228710000000001e-10 ] [ 2.71964e-10 2.8128e-10 -5.74889e-12 ] [ 4.09713e-10 4.052900000000001e-10 1.34951e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6452363 0.3075149 0.9898933 ] [ -0.4673077 -0.3961812 -2.4664226 ] [ -0.6907427 0.5218357 0.6110099 ] [ -0.4982541 1.7664351 -0.9885184 ] [ 1.1092833 0.2131442 -0.1069777 ] [ 0.3223619 -1.6351431 -1.8893668 ] [ 0.0091122 -1.9300387 2.8772717 ] [ -0.4296892 1.152433 0.9731105 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.033782514751495e-09 4.926931833276499e-10 1.585983902346561e-09 ] [ -7.487094716598202e-10 -6.34752256240489e-10 -3.95164462673275e-09 ] [ -1.106691804928268e-09 8.360729584388026e-10 9.789457768573459e-10 ] [ -7.982910702377452e-10 2.83014101938051e-09 -1.583781069710623e-09 ] [ 1.777267769103873e-09 3.414946540991194e-10 -1.713971698869562e-10 ] [ 5.164806996166675e-10 -2.619788046482437e-09 -3.027099315075709e-09 ] [ 1.459935380405376e-11 -3.092262882379225e-09 4.609897449429471e-09 ] [ -6.884379904502554e-10 1.846401209638406e-09 1.559094892554998e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.419591 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.835061723929809e-18 } }