{ "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" [ [ 2.9334662 -4.4306098 1.0286481 ] [ -0.2719955 2.3682426 4.374441 ] [ 2.928042 0.6077063 -1.9386599 ] [ -1.743672 -0.1911827 -1.7176135 ] [ 1.467998 0.6615411 -0.3310978 ] [ -6.2869679 2.616482 -4.6214515 ] [ 3.9460294 0.6993147 1.7553336 ] [ -2.9729002 -2.3314942 1.4504001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.699930963547017e-09 -7.098619437447364e-09 1.648075936850341e-09 ] [ -4.357848310628064e-10 3.794342926102606e-09 7.008627099268973e-09 ] [ 4.691240437120474e-09 9.73652826172871e-10 -3.106075567462466e-09 ] [ -2.793670512743578e-09 -3.063084522414202e-10 -2.751920193270461e-09 ] [ 2.351992074981159e-09 1.059905684118315e-09 -5.304771543583143e-10 ] [ -1.007283298510007e-08 4.192066289144025e-09 -7.404381547461091e-09 ] [ 6.322236049669452e-09 1.120425662921766e-09 2.812354455624699e-09 ] [ -4.763111196411645e-09 -3.735465498770799e-09 2.323797131025982e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.995379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.126224820743529e-18 } }