{ "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" [ [ -2.9903693 -0.3266800000000001 -1.9455039 ] [ 3.2205723 -1.3040675 -0.5541588 ] [ -1.6470978 3.5312776 1.2685393 ] [ 0.3355287 -0.14100350000000006 -2.450382 ] [ -2.8542465 4.0359132 5.6962221 ] [ -2.5420071 -1.9651919 2.261372 ] [ 3.049889 -0.5351822 -2.6271887 ] [ 3.4277307 -3.2950656 -1.6489001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.791099780018061e-09 -5.233990584829442e-10 -3.117040864255221e-09 ] [ 5.159925644656084e-09 -2.089346460445104e-09 -8.87860273570583e-10 ] [ -2.638941587331114e-09 5.657730412274734e-09 2.032424009025997e-09 ] [ 5.37576238747417e-10 -2.259125111509729e-10 -3.925944752429145e-09 ] [ -4.573007012300227e-09 6.466245772618115e-09 9.126353875504279e-09 ] [ -4.072744345527608e-09 -3.148584517565532e-09 3.623117349331738e-09 ] [ 4.886460851835091e-09 -8.574564087083098e-10 -4.209220313569946e-09 ] [ 5.491829989938418e-09 -5.279277068322325e-09 -2.641829190254782e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.214458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.597842552654353e-18 } }