Dynamical matrix file 1 1 2 9.2700000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 1 'Pb ' 188851.24696980685 1 1 0.0000000000 0.0000000000 0.0000000000 Dynamical Matrix in cartesian axes q = ( 0.000000000 0.000000000 0.000000000 ) 1 1 -0.00075311 0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000 -0.00000000 0.00000000 -0.00075311 0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000 -0.00000000 0.00000000 -0.00075311 0.00000000 Diagonalizing the dynamical matrix q = ( 0.000000000 0.000000000 0.000000000 ) ************************************************************************** freq ( 1) = -0.207751 [THz] = -6.929833 [cm-1] ( 0.221325 0.000000 -0.216065 0.000000 0.950963 0.000000 ) freq ( 2) = -0.207751 [THz] = -6.929833 [cm-1] ( 0.659335 0.000000 0.751650 0.000000 0.017327 0.000000 ) freq ( 3) = -0.207751 [THz] = -6.929833 [cm-1] ( -0.718535 0.000000 0.623168 -0.000000 0.308818 0.000000 ) **************************************************************************