{ "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" [ [ -3.248571714157459e-10 -1.35955549032369e-09 3.278617812980308e-09 ] [ 2.918334273431405e-10 -2.268905758909064e-09 -4.842793848470511e-09 ] [ -1.919436430897574e-10 7.459958651171712e-10 4.134594451361647e-09 ] [ -1.445866507280469e-09 5.391050356789843e-10 -9.044703590337408e-10 ] [ 2.523532319240352e-10 -4.324061449830972e-09 -3.667013784388416e-09 ] [ 2.901382603912693e-09 3.892450929735998e-09 1.919574538522287e-09 ] [ -3.000739023569011e-10 -2.199053261507115e-09 9.95863159796373e-10 ] [ -1.182828199254657e-09 4.974024450474012e-09 -9.143719707679468e-10 ] ] "source-value" [ [ -0.20275989999999997 -0.8485677999999999 2.0463522999999997 ] [ 0.18214809999999998 -1.4161395999999997 -3.0226341999999997 ] [ -0.11980179999999999 0.4656139999999999 2.5806108999999995 ] [ -0.9024388999999999 0.3364828999999999 -0.5645259999999999 ] [ 0.15750649999999997 -2.6988668999999996 -2.2887699999999995 ] [ 1.8109005999999999 2.4294767999999998 1.1981041999999997 ] [ -0.18729139999999997 -1.3725410999999998 0.6215688999999999 ] [ -0.7382632999999998 3.1045418999999996 -0.5707060999999999 ] ] } "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" -5.768519643861759e-18 "source-value" -36.004268 } }