{ "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" [ [ 0.4333494 0.2248273 0.4582576 ] [ -0.0967659 -0.1313127 -1.4994721 ] [ -0.495053 0.3214911 0.3275858 ] [ -0.414411 0.9493539 -0.5397516 ] [ 0.7200557 -0.0009675 0.005199 ] [ 0.2059052 -0.8493694 -1.0052303 ] [ -0.1330778 -1.0607713 1.6103166 ] [ -0.2200025 0.5467485 0.6430949 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.943022773177075e-10 3.602130437775878e-10 7.342096130239181e-10 ] [ -1.550360626706707e-10 -2.103861379541242e-10 -2.40241914216188e-09 ] [ -7.931623426569024e-10 5.150855242152749e-10 5.248503100660647e-10 ] [ -6.639596156023488e-10 1.521032623445301e-09 -8.647773945593933e-10 ] [ 1.153656408213779e-09 -1.550105880624e-12 8.329716251539199e-12 ] [ 3.298964975411482e-10 -1.360839795102924e-09 -1.61055648517977e-09 ] [ -2.132141399074982e-10 -1.699542976875623e-09 2.580011608606145e-09 ] [ -3.52482862017552e-10 8.759876641574688e-10 1.030351613735714e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.391008 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.388523263774577e-18 } }