{ "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" [ 5.48715 0 0 ] "si-unit" "m" "si-value" [ 5.48715e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0853536 5.45185 0 ] "si-unit" "m" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0925937 0.0373061 5.50955 ] "si-unit" "m" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.108625 -0.0346204 -0.093953 ] [ 1.31877 1.39109 1.34024 ] [ -0.0198257 2.75858 2.57664 ] [ 1.43337 4.133 3.94558 ] [ 2.6449 -0.0446732 2.70542 ] [ 4.12571 1.36749 4.0773 ] [ 2.7517 2.72879 0.0316261 ] [ 4.07324 4.11206 1.36119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08625e-11 -3.46204e-12 -9.3953e-12 ] [ 1.31877e-10 1.39109e-10 1.34024e-10 ] [ -1.98257e-12 2.75858e-10 2.57664e-10 ] [ 1.43337e-10 4.133e-10 3.94558e-10 ] [ 2.6449e-10 -4.467320000000001e-12 2.70542e-10 ] [ 4.12571e-10 1.36749e-10 4.0773e-10 ] [ 2.7517e-10 2.72879e-10 3.16261e-12 ] [ 4.07324e-10 4.11206e-10 1.36119e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4408023 -1.3336563 1.227717 ] [ 2.1800352 -2.1070928 -0.9426178 ] [ -0.1163842 0.2833849 4.5359921 ] [ -4.28993 -4.9737619 4.1298946 ] [ 3.5308794 6.1617195 -2.2063256 ] [ -1.7941761 1.0174532 -1.097239 ] [ 0.149553 -0.6442166 -2.717745 ] [ 1.7808251 1.5961699 -2.9296762 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.308419779273458e-09 -2.136752961646894e-09 1.967019490564578e-09 ] [ 3.492801458737516e-09 -3.375934849829635e-09 -1.510240213952485e-09 ] [ -1.864680458067828e-10 4.540326652084266e-10 7.26746055462859e-09 ] [ -6.87322560749562e-09 -7.968845099259444e-09 6.616820629002776e-09 ] [ 5.657092472151938e-09 9.872163008162161e-09 -3.53492332331603e-09 ] [ -2.874587024701247e-09 1.630139743228529e-09 -1.757970687713526e-09 ] [ 2.39610322144602e-10 -1.032148783754924e-09 -4.354307536170329e-09 ] [ 2.853196364460713e-09 2.557346117674116e-09 -4.693858752825911e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.592265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.702509533413601e-18 } }