{ "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" [ 5.36838 0 0 ] "si-unit" "m" "si-value" [ 5.368380000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0320632 5.46183 0 ] "si-unit" "m" "si-value" [ -3.20632e-12 5.46183e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0835799 0.195471 5.46165 ] "si-unit" "m" "si-value" [ -8.35799e-12 1.95471e-11 5.461649999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0445787 0.0905296 0.00673122 ] [ 1.23056 1.45848 1.40837 ] [ -0.162897 2.78891 2.76222 ] [ 1.2265 4.23635 3.86532 ] [ 2.68005 0.105406 2.5782 ] [ 3.88338 1.64051 4.20954 ] [ 2.69942 2.77008 0.000613011 ] [ 4.15957 4.14184 1.16379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.45787e-12 9.05296e-12 6.731220000000001e-13 ] [ 1.23056e-10 1.45848e-10 1.40837e-10 ] [ -1.62897e-11 2.78891e-10 2.76222e-10 ] [ 1.2265e-10 4.23635e-10 3.86532e-10 ] [ 2.68005e-10 1.05406e-11 2.5782e-10 ] [ 3.88338e-10 1.64051e-10 4.20954e-10 ] [ 2.69942e-10 2.77008e-10 6.13011e-14 ] [ 4.159570000000001e-10 4.14184e-10 1.16379e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0069200000000005 0.08712990000000001 -1.6956493000000004 ] [ 0.5088573000000001 0.3913606000000001 -0.8859783000000002 ] [ 0.9401627000000002 0.4835274000000001 -1.0355525000000003 ] [ 0.35450410000000004 0.6034031000000001 2.3675722000000006 ] [ 0.8072906000000002 -0.031374200000000005 0.8128195000000003 ] [ -0.12361600000000003 -1.9085040000000004 -1.8442212000000004 ] [ -1.8026595000000005 0.7886020000000002 -0.06903560000000002 ] [ -2.6914592000000006 -0.4141447000000001 2.3500452000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.21544033030728e-09 1.395974899027566e-10 -2.716729687918457e-09 ] [ 8.152792761003281e-10 6.270288087882204e-10 -1.419493730491042e-09 ] [ 1.506306710098352e-09 7.746963021787717e-10 -1.659138018780285e-09 ] [ 5.679781856771994e-10 9.667583477031655e-10 3.793268858147975e-09 ] [ 1.293422136167841e-09 -5.02670101504428e-11 1.302280410559563e-09 ] [ -1.98054666788544e-10 -3.057760514695537e-09 -2.954768114567441e-09 ] [ -2.888178929958123e-09 1.263479697925668e-09 -1.106072252341704e-10 ] [ -4.312193041604334e-09 -6.635329614349399e-10 3.765187508283857e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.677737 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.716203657539725e-18 } }