{ "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" [ [ -0.6204849 -0.0281532 -3.5549985 ] [ 0.9537143 0.036587 0.9692979 ] [ 1.81353 5.002722 -8.6111524 ] [ -0.9564871 -0.7400813 7.2158705 ] [ 1.4347818 0.5400628 -5.6904275 ] [ -3.3891618 -4.3044121 9.8598598 ] [ -0.9487278 -0.3144676 -3.1125857 ] [ 1.7128355 -0.1922576 2.9241359 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.94126400339426e-10 -4.510639884070656e-11 -5.695735483679068e-09 ] [ 1.528018754382637e-09 5.861883602520961e-11 1.552986433970536e-09 ] [ 2.905595367119424e-09 8.015244228761819e-09 -1.379658705342581e-08 ] [ -1.532461269716792e-09 -1.185740956351271e-09 1.156109901382041e-08 ] [ 2.298773855909342e-09 8.652759919237861e-10 -9.117069902857393e-09 ] [ -5.430035800068445e-09 -6.896428432908633e-09 1.579723685592577e-08 ] [ -1.520029500663018e-09 -5.038326367190861e-10 -4.986912038776403e-09 ] [ 2.744264993376278e-09 -3.080306318911181e-10 4.684982175021967e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.322111 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.499008382070251e-18 } }