{ "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" [ [ -1.976481929481158e-10 -3.522963686588909e-10 -1.546627074527257e-09 ] [ 1.142017396151977e-09 3.074399093710291e-10 9.210278931037364e-10 ] [ 8.308012686380856e-09 8.008931332440542e-09 -1.038579912207156e-08 ] [ -1.146210612803935e-09 -1.684444064401204e-09 5.382804594593234e-09 ] [ 1.954763784515566e-09 1.763755812572356e-09 -4.875679484918404e-09 ] [ -9.687776750858022e-09 -7.942393578249366e-09 1.067160916640881e-08 ] [ -1.140611486167225e-09 -8.603624366631168e-10 -2.175044324409102e-09 ] [ 7.674531757288973e-10 7.59369553806313e-10 2.00770835182055e-09 ] ] "source-value" [ [ -0.1233623 -0.2198861 -0.9653287 ] [ 0.7127912 0.1918889 0.5748604 ] [ 5.1854537 4.9987818 -6.482306 ] [ -0.7154084 -1.0513473 3.3596824 ] [ 1.2200676 1.1008498 -3.0431598 ] [ -6.0466347 -4.9572522 6.6606946 ] [ -0.7119137 -0.536996 -1.3575559 ] [ 0.4790066 0.4739612 1.253113 ] ] } "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" -9.66850881459862e-18 "source-value" -60.346086 } }