Structure of the input data: =============================================================================== &inputgw ... / Frequencies ... / K_points ... / ======================================================================== NAMELIST: &inputgw +-------------------------------------------------------------------- Variable: do_coulomb, do_green, do_sigma_exx, do_sigma_c, do_sigma_matel. Type: LOGICAL Default: .false. Description: control variables for determining which aspects of the calculation are to be run. In order perform calculation of screened coulomb interaction, green's function, exact exchange component of the interaction, the correlation energy, and the matrix elements of the single particle states with the various operators. +-------------------------------------------------------------------- +-------------------------------------------------------------------- Variable: prefix Type: CHARACTER Default: 'sgw' Description: prepended to input/output filenames: prefix.wfc, prefix.rho, etc. Must be the same as the underlying scf calculation. +-------------------------------------------------------------------- +-------------------------------------------------------------------- Variable: use_symm Type: LOGICAL Default: .TRUE. Description: Logical variable to determine whether or not symmetry is used to reduced the number of independent solutions of the Sternheimer equation required. use_symm only calculates electronic response to unique G vectors. +-------------------------------------------------------------------- K_Points ======================================================================== Line of input: nqs xq(1) xq(2) xq(3) DESCRIPTION OF ITEMS: +-------------------------------------------------------------------- Variable : nqs Type: INTEGER Description: number of q points Variables: xq(1) xq(2) xq(3) Type: REAL Description: The electric field wavevectors, or the point at which Sigma_{q} is calculated in units of 2pi/a0 (a0 = lattice parameter). +-------------------------------------------------------------------- ===End of line-of-input=================================================