{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.18551e-10 0.0 0.0 ] "source-value" [ 5.18551 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] "source-value" [ 0.238045 5.44258 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] "source-value" [ 0.0219846 -0.0831786 5.06218 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.795111429721441e-10 -7.764303155311356e-09 -2.08247600665979e-09 ] [ 4.937110140913118e-09 -1.23761366749694e-09 1.871675866266851e-09 ] [ 2.768768041744145e-09 -3.547789893981191e-09 2.852408710927037e-09 ] [ -9.292849025802237e-09 1.030843978633052e-08 -1.162565791966723e-09 ] [ -6.364892560239292e-09 -4.554635654077824e-10 -7.596416354400573e-09 ] [ 7.943446208289232e-09 -1.40662327378358e-09 -1.059737615790793e-09 ] [ 2.202115181247126e-09 -2.80845459751201e-09 1.243586325591023e-08 ] [ -1.514186682962285e-09 6.911808206944678e-09 -5.258752224503904e-09 ] ] "source-value" [ [ -0.4241175 -4.8460969 -1.2997793 ] [ 3.0815018 -0.7724577 1.1682082 ] [ 1.7281291 -2.2143563 1.7803335 ] [ -5.8001402 6.4340221 -0.7256165 ] [ -3.9726535 -0.284278 -4.7413102 ] [ 4.9579092 -0.8779452 -0.6614362 ] [ 1.3744522 -1.7528995 7.7618554 ] [ -0.945081 4.3140114 -3.282255 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.356040734964478e-18 "source-value" -27.188268 } }