{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.48715e-10 0.0 0.0 ] "source-value" [ 5.48715 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] "source-value" [ 0.0853536 5.45185 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] "source-value" [ -0.0925937 0.0373061 5.50955 ] } "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" [ [ -1.981617866856795e-09 -6.612096396504077e-10 8.549621401450484e-10 ] [ 1.348136457111924e-09 -1.247833311290375e-09 -9.613115800981728e-10 ] [ -2.848075624256084e-10 -1.146431072306957e-10 3.401819267066331e-09 ] [ -2.36520554600822e-09 -2.784345524375198e-09 2.770455454161172e-09 ] [ 2.211171805031522e-09 3.721410885017818e-09 -5.025355145268864e-10 ] [ -1.485617630766152e-09 8.206955876676883e-10 -4.065507153513792e-10 ] [ 6.893196682446816e-10 -6.656560002084518e-10 -2.597420379114772e-09 ] [ 1.868620515450985e-09 9.31581110069622e-10 -2.559418512063679e-09 ] ] "source-value" [ [ -1.2368286 -0.4126946 0.5336254 ] [ 0.8414406 -0.7788363 -0.6000035 ] [ -0.1777629 -0.0715546 2.1232486 ] [ -1.4762452 -1.7378518 1.7291823 ] [ 1.3801049 2.322722 -0.313658 ] [ -0.9272496 0.5122379 -0.253749 ] [ 0.4302395 -0.4154698 -1.6211823 ] [ 1.1663012 0.5814472 -1.5974634 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.436980755066627e-18 "source-value" -33.934965 } }