{ "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" [ 5.18551 0 0 ] "si-unit" "m" "si-value" [ 5.18551e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.238045 5.44258 0 ] "si-unit" "m" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0219846 -0.0831786 5.06218 ] "si-unit" "m" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7273572 -3.2108474 0.220471 ] [ 3.306898 -2.3545612 -0.3491603 ] [ 2.5137634 0.1533965 0.2845494 ] [ -7.546677 5.6933242 -0.6902567 ] [ -1.305363 -1.5306026 -2.147138 ] [ 2.9320506 -3.9257414 -1.525674 ] [ 2.0869671 0.4986141 8.1700947 ] [ -1.2602818 4.6764178 -3.9628862 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.16535470081055e-09 -5.144344637236466e-09 3.532334817643968e-10 ] [ 5.298234662970279e-09 -3.772422906882793e-09 -5.594164695715142e-10 ] [ 4.027492949702719e-09 2.457682860125472e-10 4.558983961426675e-10 ] [ -1.209110945412908e-08 9.121710927874863e-09 -1.105913147090559e-09 ] [ -2.091422080257351e-09 -2.452295701455694e-09 -3.440094305231271e-09 ] [ 4.697662922322612e-09 -6.289731090386661e-09 -2.444399213762419e-09 ] [ 3.343689895998776e-09 7.988678538212333e-10 1.308993471806199e-08 ] [ -2.019194035579741e-09 7.49244726825297e-09 -6.349243620530953e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 184.64449 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.958330850375394e-17 } }