{ "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" [ 5.46402 0 0 ] "si-unit" "m" "si-value" [ 5.46402e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0122514 5.46447 0 ] "si-unit" "m" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0384841 0.0769758 5.42124 ] "si-unit" "m" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1735024 0.5932519 -0.2621808 ] [ 0.4220522 1.7534092 0.9234058 ] [ 0.3719941 -0.4127519 0.0348296 ] [ -0.8291237 -0.5600431 -1.5536078 ] [ 0.3891072 -0.3057912 -0.8176532 ] [ 0.715759 -0.6349821 -0.0816797 ] [ -0.3010255 -0.7190258 1.2675163 ] [ -0.5952607 0.285933 0.4893699 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.7798148893269e-10 9.504943244251796e-10 -4.200599481826406e-10 ] [ 6.762021675972057e-10 2.809271226935631e-09 1.479459184271121e-09 ] [ 5.960002500955373e-10 -6.613014443707794e-10 5.580317083181569e-11 ] [ -1.328402607891193e-09 -8.972879614603565e-10 -2.489154095052522e-09 ] [ 6.234184588249498e-10 -4.89931511486377e-10 -1.310024840962306e-09 ] [ 1.146772335927187e-09 -1.017353475246488e-09 -1.308653057339578e-10 ] [ -4.822960183646305e-10 -1.152006326512017e-09 2.030784982342919e-09 ] [ -9.537127768210425e-10 4.581151677152064e-10 7.840570127032339e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 646.49629 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.035801241271937e-16 } }