{ "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" [ 5.41274 0 0 ] "si-unit" "m" "si-value" [ 5.412740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00162551 5.52562 0 ] "si-unit" "m" "si-value" [ 1.62551e-13 5.52562e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0447781 -0.0207227 5.37358 ] "si-unit" "m" "si-value" [ 4.47781e-12 -2.07227e-12 5.37358e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8340947 -1.3927408 4.58449 ] [ -0.6976365 -0.2063812 0.206311 ] [ -2.8703643 -3.3892458 -1.9824295 ] [ 2.569435 2.4861353 -0.205033 ] [ -0.331248 -0.3260482 -0.1389433 ] [ -0.291138 1.0745555 -4.1580867 ] [ 1.0714254 0.8242611 2.1126251 ] [ -0.2845682 0.9294641 -0.4189336 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.33636703888324e-09 -2.231416766978467e-09 7.345162756806659e-09 ] [ -1.117736899325541e-09 -3.306591363368808e-10 3.30546663537174e-10 ] [ -4.598830612527765e-09 -5.430170427642637e-09 -3.176202223452303e-09 ] [ 4.116688719581789e-09 3.98322788662258e-09 -3.284990817989219e-10 ] [ -5.307178056592319e-10 -5.223868075977588e-10 -2.226117087108522e-10 ] [ -4.66454500869492e-10 1.721627714036187e-09 -6.661989352886167e-09 ] [ 1.716612740954104e-09 1.320611874735137e-09 3.384798571621913e-09 ] [ -4.559285208194387e-10 1.489165663161839e-09 -6.712056251175024e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.43884 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.677928138406455e-18 } }