{ "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" [ 5.44188 0 0 ] "si-unit" "m" "si-value" [ 5.44188e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0681259 5.43851 0 ] "si-unit" "m" "si-value" [ -6.812590000000001e-12 5.43851e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00252152 -0.017859 5.5414 ] "si-unit" "m" "si-value" [ -2.52152e-13 -1.7859e-12 5.5414e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00431502 -0.0137584 0.0307734 ] [ 1.33409 1.32426 1.37744 ] [ 0.0396224 2.60036 2.83022 ] [ 1.35045 4.04355 3.98016 ] [ 2.67673 0.013858 2.80413 ] [ 4.08887 1.41719 3.918 ] [ 2.72143 2.70354 0.017408 ] [ 3.9766 4.07774 1.36794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.31502e-13 -1.37584e-12 3.07734e-12 ] [ 1.33409e-10 1.32426e-10 1.37744e-10 ] [ 3.962240000000001e-12 2.60036e-10 2.83022e-10 ] [ 1.35045e-10 4.04355e-10 3.98016e-10 ] [ 2.67673e-10 1.3858e-12 2.80413e-10 ] [ 4.08887e-10 1.41719e-10 3.918e-10 ] [ 2.72143e-10 2.70354e-10 1.7408e-12 ] [ 3.9766e-10 4.077740000000001e-10 1.36794e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1709815 -0.141526 -0.4477926 ] [ 0.0865554 0.0716241 -0.5372034 ] [ 0.0338703 0.5746155 -0.4816273 ] [ -0.1571571 0.0560827 0.771788 ] [ 0.2143589 -0.064633 -0.0876804 ] [ -0.2517767 -0.3379237 0.9280608 ] [ -0.0478295 -0.1422354 -0.2263437 ] [ 0.2929601 -0.0160042 0.0807986 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.739425618893152e-10 -2.267496484353408e-10 -7.174428346872461e-10 ] [ 1.386770382839923e-10 1.147544585058413e-10 -8.606947280942708e-10 ] [ 5.426620279948224e-11 9.206355200493024e-10 -7.716519999990279e-10 ] [ -2.517934314127276e-10 8.985439077134015e-11 1.23654068981399e-09 ] [ 3.434408180404051e-10 -1.035534815321664e-10 -1.404794869823923e-10 ] [ -4.033907424021754e-10 -5.414134517542329e-10 1.486917316440945e-09 ] [ -7.66313066845536e-11 -2.278862325301364e-10 -3.62642584405369e-10 ] [ 4.693738230472301e-10 -2.564155507460736e-11 1.294536279133709e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 147.2235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.358780497323488e-17 } }