{ "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" [ 5.4207 0 0 ] "si-unit" "m" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.121917 5.37017 0 ] "si-unit" "m" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0328689 -0.300504 5.4102 ] "si-unit" "m" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.34364169999999994 6.1955051999999995 -1.8115670999999998 ] [ -1.6476398999999997 -7.015168599999999 -0.49117639999999996 ] [ -0.5304537999999999 5.031221099999999 -0.6020830999999999 ] [ -0.9774954999999999 -2.9758696999999996 0.8621967999999999 ] [ -0.5669204999999999 1.0970989999999998 -2.8704980999999994 ] [ -0.44478409999999996 -2.3190176999999994 5.771400099999999 ] [ 6.140633099999999 4.550854999999999 -3.5338498999999994 ] [ -2.3169810999999996 -4.564624299999999 2.6755777999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.505747022080377e-10 9.926293667265494e-09 -2.902450478543141e-09 ] [ -2.639810149026096e-09 -1.123953921449049e-08 -7.869513512522375e-10 ] [ -8.498806837765089e-10 8.060904886907775e-09 -9.646434745462852e-10 ] [ -1.566120449940147e-09 -4.767868899168589e-09 1.381391566869571e-09 ] [ -9.083067784355968e-10 1.757746382984766e-09 -4.599044983761394e-09 ] [ -7.126226921947193e-10 -3.71547597277242e-09 9.24680238568526e-09 ] [ 9.838378870786984e-09 7.291273545722068e-09 -5.661851737843235e-09 ] [ -3.712212979839616e-09 -7.313334396448605e-09 4.286748233609124e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.334331292303478 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.379442690254365e-18 } }