{ "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" [ 5.52526 0 0 ] "si-unit" "m" "si-value" [ 5.52526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.163004 5.51064 0 ] "si-unit" "m" "si-value" [ 1.63004e-11 5.510640000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0929221 -0.0543858 5.47616 ] "si-unit" "m" "si-value" [ 9.29221e-12 -5.43858e-12 5.47616e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515746 -0.0381365 -0.00729456 ] [ 1.44408 1.32704 1.45073 ] [ 0.0791767 2.70101 2.71983 ] [ 1.48556 4.06547 4.00394 ] [ 2.80111 0.011527 2.65388 ] [ 4.15958 1.27318 3.97985 ] [ 2.73428 2.80936 0.100172 ] [ 4.13679 4.02299 1.21489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15746e-12 -3.81365e-12 -7.29456e-13 ] [ 1.44408e-10 1.32704e-10 1.45073e-10 ] [ 7.917670000000001e-12 2.70101e-10 2.71983e-10 ] [ 1.48556e-10 4.06547e-10 4.00394e-10 ] [ 2.80111e-10 1.1527e-12 2.65388e-10 ] [ 4.15958e-10 1.27318e-10 3.97985e-10 ] [ 2.73428e-10 2.80936e-10 1.00172e-11 ] [ 4.136790000000001e-10 4.02299e-10 1.21489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5465903 0.4912649 -0.012425799999999997 ] [ -0.8807677 0.3719862 -1.8362784999999995 ] [ -0.9636717 0.2717209 -0.24150689999999994 ] [ 1.117042 0.0363523 0.31294599999999995 ] [ -0.2900806 -1.8414671 0.6213985999999999 ] [ 0.9018007 0.869121 1.8879014999999995 ] [ -0.8511822 -1.8527777 -2.6037361999999997 ] [ 2.5134498 1.6537995 1.8717012999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.47791084103105e-09 7.870931438843465e-10 -1.990832641875719e-11 ] [ -1.411145428921922e-09 5.959875978104507e-10 -2.942042506216568e-09 ] [ -1.543972280587058e-09 4.353448769494505e-10 -3.869367121297744e-10 ] [ 1.789698591596628e-09 5.824280565215819e-11 5.013947689037638e-10 ] [ -4.647603592967004e-10 -2.950355559899741e-09 9.955903173203123e-10 ] [ 1.444844010064844e-09 1.392485358318714e-09 3.02475167059355e-09 ] [ -1.363744232116715e-09 -2.968477138936262e-09 -4.17164530073995e-09 ] [ 4.026990540291973e-09 2.649678916220883e-09 2.998796088687423e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.961268 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.761630331861191e-18 } }