{ "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" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.1484921 1.8783044 2.3640582 ] [ -6.655509 8.5966872 -10.6876103 ] [ -0.6736176 2.1746929 0.8140888 ] [ 1.8080075 -1.4657229 -2.7123227 ] [ 1.8727588 -0.0568638 19.1082308 ] [ -5.941084 1.1359216 -3.4220834 ] [ -4.0168544 -5.3702387 -3.7219131 ] [ 10.4578067 -6.8927807 -1.7424482 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.044440433393496e-09 3.009375396425772e-09 3.787638778250531e-09 ] [ -1.066330091932399e-08 1.377341124817061e-08 -1.712343935488127e-08 ] [ -1.079254370079406e-09 3.484242121799753e-09 1.304314042615127e-09 ] [ 2.896747346731056e-09 -2.348346962951177e-09 -4.345620018005132e-09 ] [ 3.000490365757463e-09 -9.110585092984704e-11 3.061476065261048e-08 ] [ -9.518665887008948e-09 1.81994703058173e-09 -5.482782017907776e-09 ] [ -6.435710208837612e-09 -8.604070893255384e-09 -5.963162153469253e-09 ] [ 1.67552533995856e-08 -1.104345208984146e-08 -2.791709768995043e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.139774 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.46979477421957e-18 } }