{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.412740000000001e-10 0.0 0.0 ] "source-value" [ 5.41274 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.62551e-13 5.52562e-10 0.0 ] "source-value" [ 0.00162551 5.52562 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.47781e-12 -2.07227e-12 5.37358e-10 ] "source-value" [ 0.0447781 -0.0207227 5.37358 ] } "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" [ [ 1.285479014478664e-09 -1.792350659812084e-09 6.390596600202111e-09 ] [ -1.117992917940743e-09 -5.856285597407886e-10 4.842479501417511e-10 ] [ -4.044977663383171e-09 -4.740782942588852e-09 -2.891366116114775e-09 ] [ 3.730045014827309e-09 3.38191366451185e-09 6.220867296177407e-11 ] [ -4.919949547563053e-10 -2.957574783228038e-10 -1.574912381243847e-10 ] [ -4.315022129554081e-10 1.504505370513439e-09 -5.916169832528202e-09 ] [ 1.423639991673097e-09 1.554242700658906e-09 2.588619302501394e-09 ] [ -3.526965923787667e-10 9.738577445626714e-10 -5.606453390396678e-10 ] ] "source-value" [ [ 0.8023329 -1.1186973 3.9886967 ] [ -0.6977963 -0.3655206 0.3022438 ] [ -2.5246765 -2.958964 -1.8046488 ] [ 2.328111 2.1108245 0.0388276 ] [ -0.3070791 -0.1845973 -0.0982983 ] [ -0.2693225 0.9390384 -3.6925828 ] [ 0.8885662 0.970082 1.6156891 ] [ -0.2201359 0.6078342 -0.3499273 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.91133e-12 1.8955e-12 -1.94937e-11 ] [ 1.34586e-10 1.33293e-10 1.3663e-10 ] [ 9.13327e-12 2.8499e-10 2.77756e-10 ] [ 1.30939e-10 4.04312e-10 4.06983e-10 ] [ 2.74681e-10 -3.01059e-12 2.75341e-10 ] [ 4.03842e-10 1.37613e-10 4.21696e-10 ] [ 2.56627e-10 2.70409e-10 -1.78064e-12 ] [ 4.07687e-10 4.07853e-10 1.33472e-10 ] ] "source-value" [ [ -0.0391133 0.018955 -0.194937 ] [ 1.34586 1.33293 1.3663 ] [ 0.0913327 2.8499 2.77756 ] [ 1.30939 4.04312 4.06983 ] [ 2.74681 -0.0301059 2.75341 ] [ 4.03842 1.37613 4.21696 ] [ 2.56627 2.70409 -0.0178064 ] [ 4.07687 4.07853 1.33472 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.72277461742e-18 "source-value" -35.71875 } }