{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46847e-10 0.0 0.0 ] "source-value" [ 5.46847 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.52926e-12 5.44594e-10 0.0 ] "source-value" [ 0.0752926 5.44594 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.12544e-13 2.01844e-11 5.40303e-10 ] "source-value" [ 0.00412544 0.201844 5.40303 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 7.950372097385625e-10 3.858440244864979e-10 1.604453313778157e-09 ] [ 2.485099306460602e-10 -1.488364722800175e-09 -2.418841292307417e-09 ] [ -3.910776946360032e-10 9.048023300295707e-10 2.222162095779562e-09 ] [ -1.860664907440403e-09 -5.144520235794105e-10 -2.798693336449786e-10 ] [ 3.626190324090432e-11 -2.793490267873738e-09 -2.491392015356456e-09 ] [ 1.067974886451312e-09 1.268769594065017e-09 1.774554322778886e-09 ] [ 8.516587723882829e-10 -3.261600614437805e-10 4.982980778001946e-10 ] [ -7.477001003887161e-10 2.563050966898357e-09 -9.093651688279468e-10 ] ] "source-value" [ [ 0.4962231999999999 0.24082489999999998 1.0014209999999997 ] [ 0.15510769999999996 -0.9289641999999999 -1.5097219999999998 ] [ -0.24409149999999996 0.5647331999999999 1.3869644999999997 ] [ -1.1613356999999997 -0.32109569999999993 -0.17468069999999997 ] [ 0.022632899999999997 -1.7435594999999997 -1.5550045999999997 ] [ 0.6665774999999999 0.7919036999999999 1.1075896999999997 ] [ 0.5315635999999999 -0.20357309999999998 0.31101319999999993 ] [ -0.4666776999999999 1.5997305999999998 -0.5675810999999998 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.436421655932132e-17 "source-value" 152.06948 } }