{ "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" [ 5.46441 0 0 ] "si-unit" "m" "si-value" [ 5.46441e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.239301 5.60761 0 ] "si-unit" "m" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.167861 -0.733416 5.71653 ] "si-unit" "m" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2265261 -1.7785099 -0.6540099 ] [ 3.2177147 -1.4785767 -0.3602728 ] [ -1.337677 3.8434796 1.1645336 ] [ -0.0455341 -0.7611175 -1.9728635 ] [ -2.809779 4.4467689 4.7853875 ] [ -3.0327172 -1.1905421 0.7761577 ] [ 2.5812672 0.4219747999999999 -1.8462471 ] [ 3.6532516 -3.5034771 -1.8926854 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.567288063021003e-09 -2.849486981641346e-09 -1.047839371551746e-09 ] [ 5.155347264744486e-09 -2.368941020799616e-09 -5.772206572701543e-10 ] [ -2.143194815581882e-09 6.157933157641737e-09 1.865788508056059e-09 ] [ -7.295367046916929e-11 -1.219444664181744e-09 -3.160875775729661e-09 ] [ -4.501762223414803e-09 7.124509169680533e-09 7.66703597396856e-09 ] [ -4.858948595338038e-09 -1.907458718698136e-09 1.2435417209939e-09 ] [ 4.135645959877878e-09 6.760781591267557e-10 -2.9580139398398e-09 ] [ 5.853154303420194e-09 -5.613189101128184e-09 -3.032416298409497e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.611588 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.142122779036184e-18 } }