{ "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" [ [ -1.8155658 0.5443091 -0.14159379999999996 ] [ -0.8298188 0.554051 -1.7521936999999996 ] [ -1.2979761 0.2061277 -0.49261319999999986 ] [ 1.4910609 0.2644147 0.37322749999999993 ] [ -0.5227059 -2.2594122 0.5889645999999998 ] [ 1.0193745 1.0906873 2.4699881999999995 ] [ -1.1753746 -2.4123515 -3.223353699999999 ] [ 3.1310059 2.0121739 2.1775739999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.908857078284049e-09 8.720793145086894e-10 -2.26858276010231e-10 ] [ -1.329516280860311e-09 8.876875589308607e-10 -2.807323781253048e-09 ] [ -2.079586961777163e-09 3.302529818392762e-10 -7.892533521374744e-10 ] [ 2.388942914169007e-09 4.236390505358457e-10 5.979763747396319e-10 ] [ -8.374671725342226e-10 -3.619977403590294e-09 9.436253125988234e-10 ] [ 1.63321799173969e-09 1.747473692663476e-09 3.957357347691874e-09 ] [ -1.883157704802152e-09 -3.865013174451812e-09 -5.164381938709175e-09 ] [ 5.016424452566863e-09 3.223857979563957e-09 3.488858152861938e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.473361 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.363023641379851e-18 } }