{ "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" [ [ 6.8643367 -8.3828749 2.4458492 ] [ -2.2035991 3.8871598 7.4195333 ] [ 4.7178855 -0.4872247 -3.5878914 ] [ -2.9253028 0.3462896 -2.140095 ] [ 2.7653952 1.8586112 0.7921236 ] [ -11.3182963 5.6672174 -8.3708896 ] [ 6.5258731 1.0828614 1.6370783 ] [ -4.4262923 -3.9720397 1.8042917 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.099787977803942e-08 -1.343084617987114e-08 3.918682406242384e-09 ] [ -3.530554959635921e-09 6.227916552873604e-09 1.188740279050707e-08 ] [ 7.55888584771132e-09 -7.806200234162938e-10 -5.748435719049382e-09 ] [ -4.686851754920778e-09 5.548171011461837e-10 -3.428810175290976e-09 ] [ 4.43065153671254e-09 2.977823411797033e-09 1.269121912703931e-09 ] [ -1.813390971914714e-08 9.079883223270961e-09 -1.341164361241786e-08 ] [ 1.045560131112762e-08 1.734935218646757e-09 2.622888578679009e-09 ] [ -7.091702039887059e-09 -6.363909144229446e-09 2.890793978843487e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -30.68568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.916387908935015e-18 } }