{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] "source-value" [ 5.4207 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] "source-value" [ -0.121917 5.37017 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] "source-value" [ -0.0328689 -0.300504 5.4102 ] } "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" [ [ 2.568702965363553e-09 7.474900229901969e-09 -2.252924848204894e-09 ] [ -7.953414630788524e-10 -9.539520779211253e-09 1.890713409528182e-09 ] [ 1.519435413572026e-10 7.347925329438637e-09 5.395855284475623e-10 ] [ -2.333340335850116e-09 -4.519256550154981e-09 3.014046702581377e-10 ] [ -1.602081932161711e-09 2.049835182799555e-09 -4.737715255013006e-09 ] [ -7.639154095325088e-10 -2.102860980459214e-09 5.64635383674342e-09 ] [ 6.648919061562261e-09 6.279588351071024e-09 -6.640966657904921e-09 ] [ -3.87488642765983e-09 -6.990610623168078e-09 5.253549316145518e-09 ] ] "source-value" [ [ 1.6032582999999998 4.665465799999999 -1.4061650999999997 ] [ -0.49641309999999994 -5.954100599999999 1.1800904999999997 ] [ 0.09483569999999998 4.586214299999999 0.33678279999999994 ] [ -1.4563564999999998 -2.8206980999999995 0.18812199999999998 ] [ -0.9999408999999999 1.2794064999999997 -2.9570492999999995 ] [ -0.47679849999999996 -1.3125025999999997 3.5241768999999996 ] [ 4.149928899999999 3.9194107999999996 -4.144965399999999 ] [ -2.4185138999999998 -4.363195999999999 3.2790075999999995 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.989892728161739e-18 "source-value" -31.144461 } }