{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.4737e-10 0.0 0.0 ] "source-value" [ 5.4737 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] "source-value" [ -0.00330015 5.48579 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] "source-value" [ 0.0734366 -0.160082 5.49307 ] } "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" [ [ 2.546079109954222e-09 9.551465646789965e-10 1.369551310043199e-09 ] [ -7.227401112485972e-10 1.276498333866094e-09 -2.209706774729463e-09 ] [ -2.510787324657212e-09 -1.376164774698538e-09 -5.160448915540437e-09 ] [ -1.302253162827792e-09 8.579432140527736e-09 -5.783147836844986e-09 ] [ -2.246469838817353e-09 -4.517262961785718e-09 -5.7181683596352e-10 ] [ 8.747346018223411e-10 1.576522088094764e-09 2.571143881445342e-09 ] [ 7.573149225077991e-10 -8.680377919391888e-09 3.613776659632474e-09 ] [ 2.604121963484254e-09 2.186206528708554e-09 6.170648511957391e-09 ] ] "source-value" [ [ 1.5891376 0.5961556 0.8548067 ] [ -0.4510989 0.7967276 -1.3791905 ] [ -1.5671102 -0.8589345 -3.2208989 ] [ -0.8128025 5.3548604 -3.609557 ] [ -1.4021362 -2.8194538 -0.3569 ] [ 0.5459664 0.9839877 1.6047818 ] [ 0.4726788 -5.4178658 2.255542 ] [ 1.6253651 1.3645228 3.8514159 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.709636608911778e-18 "source-value" -35.636749 } }