{ "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" [ [ -4.134496878805439e-10 1.854115802219922e-08 -5.166386742314784e-09 ] [ -3.860973286102464e-10 -1.690942925362856e-08 -1.728412116752832e-09 ] [ -8.152273107955994e-09 1.201082486431378e-08 5.676056749334093e-09 ] [ -3.981601644535483e-09 -7.379958127271278e-09 2.055396337850352e-09 ] [ -1.999699231110833e-09 4.027695304609926e-09 -8.773719607796063e-09 ] [ -2.601289155001017e-09 -1.454020785192031e-09 1.857443763387817e-08 ] [ 2.409096661838518e-08 9.222723837939427e-09 -1.561343194963435e-08 ] [ -6.556556463291058e-09 -1.805899354253516e-08 4.976059695435413e-09 ] ] "source-value" [ [ -0.2580549999999999 11.572480699999998 -3.2246049999999995 ] [ -0.24098299999999998 -10.554035699999998 -1.0787899999999997 ] [ -5.088248699999999 7.496567299999999 3.5427159999999995 ] [ -2.4851202999999997 -4.606207599999999 1.2828774999999997 ] [ -1.2481140999999998 2.5138896999999996 -5.476125099999999 ] [ -1.6235969999999997 -0.9075283999999999 11.593252199999998 ] [ 15.036398799999999 5.756371499999999 -9.745137799999998 ] [ -4.092280699999999 -11.271537299999999 3.1058121999999995 ] ] } "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" -3.527032894770417e-18 "source-value" -22.014008 } }