{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44188e-10 0.0 0.0 ] "source-value" [ 5.44188 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.812590000000001e-12 5.43851e-10 0.0 ] "source-value" [ -0.0681259 5.43851 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.52152e-13 -1.7859e-12 5.5414e-10 ] "source-value" [ -0.00252152 -0.017859 5.5414 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.427306011541926e-10 -1.685247876411859e-10 -2.881523464480215e-09 ] [ 9.029258607712896e-10 1.719209214242957e-10 1.385205056281402e-10 ] [ 1.374643027344102e-09 4.421040239382023e-09 -6.550122923070237e-09 ] [ -1.023106571056456e-09 -6.282770594275257e-10 6.185904277522987e-09 ] [ 1.542537518702665e-09 2.851082909773324e-10 -4.383837057376399e-09 ] [ -3.019966104324584e-09 -3.749212013959601e-09 8.055513816601991e-09 ] [ -9.424714249965236e-10 -2.726340642431079e-10 -2.486785276918669e-09 ] [ 1.7081682947137e-09 -5.942168672989248e-11 1.922330122092401e-09 ] ] "source-value" [ [ -0.3387458 -0.1051849 -1.7985055 ] [ 0.563562 0.1073046 0.0864577 ] [ 0.8579847 2.7593963 -4.0882652 ] [ -0.6385729 -0.3921397 3.8609378 ] [ 0.9627762 0.1779506 -2.7361759 ] [ -1.8849146 -2.3400741 5.0278563 ] [ -0.5882444 -0.1701648 -1.5521293 ] [ 1.0661548 -0.0370881 1.1998241 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.679499666674531e-18 "source-value" -35.448649 } }