{ "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" [ [ -1.495078 -3.5631985 -0.8973992 ] [ 3.3141315 0.6930087 0.0044788 ] [ 4.3890913 -4.0677357 5.0345091 ] [ -14.6227325 12.1340508 -7.9177872 ] [ -3.6651881 -3.7227891 -3.793193 ] [ 9.3807478 -5.8608233 -4.2728667 ] [ 7.0205064 -2.3268517 17.4269684 ] [ -4.3214785 6.7143388 -5.5847102 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.395379017872422e-09 -5.708873331969629e-09 -1.437792017764623e-09 ] [ 5.309824007556835e-09 1.110322337151001e-09 7.17582864923904e-12 ] [ 7.032099467416678e-09 -6.517231038133523e-09 8.06617277722485e-09 ] [ -2.342820014371234e-08 1.944089250735954e-08 -1.26856935403095e-08 ] [ -5.872278684654373e-09 -5.964565660189073e-09 -6.077365142782215e-09 ] [ 1.502961481078103e-08 -9.390074069899904e-09 -6.845887130534847e-09 ] [ 1.124809122025677e-08 -3.728027393808736e-09 2.792108134190038e-08 ] [ -6.923771819989852e-09 1.075755664949033e-08 -8.947692116383291e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.2213 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.040897720618304e-18 } }