{ "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" [ 5.18551 0 0 ] "si-unit" "m" "si-value" [ 5.18551e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.238045 5.44258 0 ] "si-unit" "m" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0219846 -0.0831786 5.06218 ] "si-unit" "m" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4241177 -4.8460969 -1.2997792 ] [ 3.0815019 -0.7724575 1.168208 ] [ 1.7281291 -2.2143563 1.7803336 ] [ -5.8001401 6.434022 -0.7256166 ] [ -3.9726535 -0.2842789 -4.7413096 ] [ 4.9579091 -0.8779451 -0.6614362 ] [ 1.3744521 -1.7528988 7.761855 ] [ -0.9450809 4.3140116 -3.2822551 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.795114690058218e-10 -7.764303219279833e-09 -2.082475863599212e-09 ] [ 4.937110341806604e-09 -1.237613357258055e-09 1.871675561251872e-09 ] [ 2.768768064555449e-09 -3.547789923210694e-09 2.852408894645102e-09 ] [ -9.292848942146423e-09 1.030843971104195e-08 -1.162565961762524e-09 ] [ -6.364892612678318e-09 -4.554650111192226e-10 -7.596415455679887e-09 ] [ 7.943446113515968e-09 -1.406623125154793e-09 -1.059737624521751e-09 ] [ 2.202115039172231e-09 -2.808453499126639e-09 1.243586271749607e-08 ] [ -1.51418653521969e-09 6.911808584324953e-09 -5.258752428047333e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.188267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.356040610635328e-18 } }