{ "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" [ 5.52208 0 0 ] "si-unit" "m" "si-value" [ 5.52208e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968577 5.45697 0 ] "si-unit" "m" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.137264 0.147448 5.57607 ] "si-unit" "m" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.124825 0.3750744 -0.856712 ] [ 0.6127974 -0.9659215 -0.4629871 ] [ -1.0583772 1.0634262 0.5240973 ] [ -1.775508 2.0749384 -1.2291107 ] [ -0.5301932 -0.3945487 -0.2375948 ] [ 2.1373945 -1.3417708 -0.3169525 ] [ 0.0984512 -0.7722051 1.3686503 ] [ 0.6402603 -0.0389929 1.2106095 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.9999169669136e-10 6.009354347405875e-10 -1.37260393715881e-09 ] [ 9.81809667567026e-10 -1.547576844828067e-09 -7.417871073519916e-10 ] [ -1.695707205827766e-09 1.703796595586185e-09 8.396964410844038e-10 ] [ -2.844677407643367e-09 3.324417794080159e-09 -1.969252427915123e-09 ] [ -8.494631495471386e-10 -6.321367029070329e-10 -3.806688337836518e-10 ] [ 3.424483497326506e-09 -2.149753806232113e-09 -5.07813885404112e-10 ] [ 1.57736210929705e-10 -1.237208957682526e-09 2.192819512710907e-09 ] [ 1.025810083886394e-09 -6.247351275719232e-11 1.939610237818377e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.415384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.834387688225439e-18 } }