{ "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" [ 5.43079 0 0 ] "si-unit" "m" "si-value" [ 5.43079e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0839771 5.43297 0 ] "si-unit" "m" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0398452 0.0785902 5.46584 ] "si-unit" "m" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5165388 1.2591232 -2.8298232 ] [ -0.7734936 0.4992991 0.4490671 ] [ -0.5978364 -0.837598 -1.6453766 ] [ -1.7841201 -1.3046483 4.201116 ] [ 4.0785845 2.0167408 -2.4000137 ] [ -0.1470988 -1.9702951 -0.3806875 ] [ -0.3850068 1.1061357 0.1643352 ] [ -1.9075675 -0.7687573 2.4413827 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.429763029914399e-09 2.017337770367309e-09 -4.533876609391108e-09 ] [ -1.239273372468542e-09 7.999653513972293e-10 7.194848147181413e-10 ] [ -9.578395110346776e-10 -1.341979944285132e-09 -2.636183942650364e-09 ] [ -2.858475536469743e-09 -2.090277021847822e-09 6.730929891923543e-09 ] [ 6.534612785694572e-09 3.231174986594467e-09 -3.845245871419885e-09 ] [ -2.356782602494392e-10 -3.156760771304693e-09 -6.099286173558749e-10 ] [ -6.168488988911111e-10 1.772224772573234e-09 2.632940175837168e-10 ] [ -3.056260076277795e-09 -1.231684983276928e-09 3.911526316591831e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.756961 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.728896741704927e-18 } }