{ "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" [ [ 2.9153368000000004 0.7884157000000003 -2.6655667000000003 ] [ 0.3952334000000001 0.15625740000000002 -0.9039984000000002 ] [ 1.0819234000000002 0.6307482000000001 -1.1692191000000003 ] [ 0.16027310000000003 0.9446983000000002 2.6115160000000004 ] [ 0.8966488000000002 0.060201900000000017 0.7222932000000001 ] [ -0.08702110000000002 -2.3373199000000002 -1.7087968000000004 ] [ -2.0528655000000002 1.0439612000000003 -0.04602180000000001 ] [ -3.309528900000001 -1.2869628000000002 3.1597937000000007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.670884462717886e-09 1.263181202011667e-09 -4.270708647923008e-09 ] [ 6.332337132392949e-10 2.50351953106994e-10 -1.448365101720607e-09 ] [ 1.733432376976447e-09 1.010570019651683e-09 -1.873295506612818e-09 ] [ 2.567858137631405e-10 1.513573529969505e-09 4.184109880045134e-09 ] [ 1.436589744428375e-09 9.645407670773955e-11 1.157241278402819e-09 ] [ -1.394231719362989e-10 -3.744799299110594e-09 -2.737794282657855e-09 ] [ -3.289053109746903e-09 1.672610227662313e-09 -7.373505200713345e-11 ] [ -5.302449829441943e-09 -2.061941709999306e-09 5.06254759269113e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.490695 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.686236178494346e-18 } }