{ "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" [ [ 13.6304269 -13.8804808 23.4051851 ] [ -5.7708287 -2.6397142 1.4081553 ] [ -21.5204609 -24.652034 -18.2380844 ] [ 24.0512218 19.9895764 11.6192464 ] [ -1.562329 -1.2792955 3.7603762 ] [ -8.741339 12.9049366 -25.3929303 ] [ 0.1534187 8.3020446 7.6592838 ] [ -0.2401098 1.2549669 -4.221232 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.183835149062505e-08 -2.223898200644563e-08 3.749924068166495e-08 ] [ -9.245886901956596e-09 -4.229288411678002e-09 2.25611351870326e-09 ] [ -3.447957960689061e-08 -3.949691285537355e-08 -2.922063267459991e-08 ] [ 3.853430558711142e-08 3.202683223163783e-08 1.861608508676862e-08 ] [ -2.503127018420586e-09 -2.049657358081347e-09 6.024786882689711e-09 ] [ -1.400516909567292e-08 2.06759878837714e-08 -4.06839595954506e-08 ] [ 2.458038563586558e-10 1.330134187254587e-08 1.227152553753473e-08 ] [ -3.846983111544132e-10 2.010678643623415e-09 -6.763159277093087e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.088073 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.660423088868628e-18 } }