{ "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" [ 5.39143 0 0 ] "si-unit" "m" "si-value" [ 5.39143e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.144963 5.17841 0 ] "si-unit" "m" "si-value" [ 1.44963e-11 5.178410000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.144779 0.421312 5.38784 ] "si-unit" "m" "si-value" [ -1.44779e-11 4.21312e-11 5.38784e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.15223 0.0692904 -0.00428898 ] [ 1.42734 1.24068 1.17973 ] [ -0.332931 2.76994 2.80275 ] [ 1.2591 4.25807 3.96691 ] [ 2.6931 0.104845 2.7319 ] [ 4.09744 1.52781 4.38962 ] [ 2.50984 2.47613 -0.202936 ] [ 4.16866 4.11218 1.07304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5223e-11 6.929040000000001e-12 -4.288980000000001e-13 ] [ 1.42734e-10 1.24068e-10 1.17973e-10 ] [ -3.32931e-11 2.76994e-10 2.80275e-10 ] [ 1.2591e-10 4.25807e-10 3.96691e-10 ] [ 2.6931e-10 1.04845e-11 2.7319e-10 ] [ 4.09744e-10 1.52781e-10 4.38962e-10 ] [ 2.50984e-10 2.47613e-10 -2.02936e-11 ] [ 4.16866e-10 4.11218e-10 1.07304e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4466029 -2.3261086 1.3713159 ] [ 0.0006064 2.3686177 4.6257892 ] [ 0.5559402 -0.386586 -2.2873851 ] [ -1.2015644 -0.27847 -3.0343739 ] [ 1.7331319 0.2976746 0.1834001 ] [ -3.2951111 1.741504 -2.2488793 ] [ 1.6220518 0.8616689 0.5493177 ] [ -1.8616577 -2.2783006 0.8408154 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.91988996676148e-09 -3.726836816361819e-09 2.197090274711311e-09 ] [ 9.7155990285312e-13 3.794943902553069e-09 7.411331308989135e-09 ] [ 8.907143910028762e-10 -6.193790511285889e-10 -3.66479492998627e-09 ] [ -1.92511839006558e-09 -4.46158123594176e-10 -4.861602921345717e-09 ] [ 2.776783410942684e-09 4.769272847259917e-10 2.938393524723821e-10 ] [ -5.279349967358571e-09 2.790196993829683e-09 -3.60310183746107e-09 ] [ 2.598813471686558e-09 1.380545766450453e-09 8.801039763316282e-10 ] [ -2.982704442872301e-09 -3.650239956474613e-09 1.3471347762886e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 168.61107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.701447143620723e-17 } }