{ "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" [ 5.39198 0 0 ] "si-unit" "m" "si-value" [ 5.39198e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0815956 5.53401 0 ] "si-unit" "m" "si-value" [ 8.15956e-12 5.534010000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109849 -0.0410552 5.55668 ] "si-unit" "m" "si-value" [ -1.09849e-11 -4.10552e-12 5.55668e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0600222 -0.0188866 -0.0475744 ] [ 1.35953 1.30974 1.45574 ] [ -0.0201429 2.70129 2.75612 ] [ 1.43727 3.87805 4.08993 ] [ 2.67575 -0.0837777 2.76281 ] [ 3.98871 1.3119 4.2787 ] [ 2.73779 2.77507 0.256836 ] [ 4.26747 4.05038 1.42682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.00222e-12 -1.88866e-12 -4.75744e-12 ] [ 1.35953e-10 1.30974e-10 1.45574e-10 ] [ -2.01429e-12 2.70129e-10 2.75612e-10 ] [ 1.43727e-10 3.87805e-10 4.08993e-10 ] [ 2.67575e-10 -8.37777e-12 2.76281e-10 ] [ 3.98871e-10 1.3119e-10 4.2787e-10 ] [ 2.73779e-10 2.77507e-10 2.56836e-11 ] [ 4.26747e-10 4.05038e-10 1.42682e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.0017560000000008 -1.9644790000000005 1.0269268000000003 ] [ -0.9356258000000002 -0.08947210000000001 -0.7530946000000002 ] [ 1.0661298000000001 -2.6167783000000004 1.9861835000000005 ] [ -0.5729648000000002 2.6649315000000002 1.2163825000000001 ] [ 0.9411079000000002 -0.9049861000000002 1.0166869000000003 ] [ -1.6410172000000005 1.5722577000000004 -1.5450979000000005 ] [ 0.5885373000000002 -1.3178087000000003 -2.1748492000000006 ] [ -2.4479231000000006 2.6563350000000003 -0.7731380000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.809343324169304e-09 -3.147442351783686e-09 1.645318123788391e-09 ] [ -1.499037794927557e-09 -1.433501080149114e-10 -1.206590571311577e-09 ] [ 1.708128254371093e-09 -4.192541048618242e-09 3.182216794536339e-09 ] [ -9.179908146644834e-10 4.26969098051057e-09 1.948859619506505e-09 ] [ 1.507821087452809e-09 -1.449947583514788e-09 1.628911995273895e-09 ] [ -2.629199413832106e-09 2.519034549566582e-09 -2.475519752622469e-09 ] [ 9.429407102974483e-10 -2.111362307221916e-09 -3.484492570713593e-09 ] [ -3.922005192648846e-09 4.25591786907639e-09 -1.238703638457492e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.601256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.70395005042523e-18 } }