{ "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" [ 5.46847 0 0 ] "si-unit" "m" "si-value" [ 5.46847e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0752926 5.44594 0 ] "si-unit" "m" "si-value" [ 7.52926e-12 5.44594e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00412544 0.201844 5.40303 ] "si-unit" "m" "si-value" [ 4.12544e-13 2.01844e-11 5.40303e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00347607 -0.00350605 -0.096896 ] [ 1.33363 1.43287 1.45525 ] [ -0.0378093 2.6958 2.61111 ] [ 1.37012 4.12622 4.01894 ] [ 2.67267 0.0858706 2.76525 ] [ 3.9434 1.3374 3.96298 ] [ 2.74102 2.68949 -0.0467586 ] [ 4.13757 3.9786 1.32692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.47607e-13 -3.50605e-13 -9.6896e-12 ] [ 1.33363e-10 1.43287e-10 1.45525e-10 ] [ -3.78093e-12 2.6958e-10 2.61111e-10 ] [ 1.37012e-10 4.12622e-10 4.01894e-10 ] [ 2.67267e-10 8.58706e-12 2.76525e-10 ] [ 3.9434e-10 1.3374e-10 3.96298e-10 ] [ 2.74102e-10 2.68949e-10 -4.67586e-12 ] [ 4.137570000000001e-10 3.9786e-10 1.32692e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.24296399999999999 -0.7821251999999999 1.2020326999999997 ] [ 0.6480188999999998 -1.5034117999999999 -2.4696657999999996 ] [ -0.22289449999999997 0.7598862999999999 2.1374893999999998 ] [ -0.6119142999999999 0.35395389999999993 -0.22156209999999998 ] [ -0.7509942999999999 -2.3746521999999994 -2.1265340999999998 ] [ 2.1106072999999994 2.4126067999999994 1.7346414999999997 ] [ -0.16952019999999998 -0.9100340999999998 0.5551468999999999 ] [ -0.7603388999999999 2.0437761999999995 -0.8115484999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.892712404960511e-10 -1.253102709978524e-09 1.9258686893771e-09 ] [ 1.038240731416533e-09 -2.408731237394845e-09 -3.956840805949328e-09 ] [ -3.571163568049056e-10 1.217472064326215e-09 3.424635543887819e-09 ] [ -9.803947853931973e-10 5.67096663420981e-10 -3.549816166753517e-10 ] [ -1.203225509814061e-09 -3.804612237371285e-09 -3.407083218353969e-09 ] [ 3.381565671749811e-09 3.8654222101431e-09 2.779202056769443e-09 ] [ -2.716013011933401e-10 -1.458035359150769e-09 8.894433842895954e-10 ] [ -1.218197209464789e-09 3.274490445787464e-09 -1.300244033345309e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.78082 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.732719327705306e-18 } }