input data description

Available Input file description for the following executables:

• PWscf: pw.x, hp.x, bgw2pw.x, pw2bgw.x, pwcond.x, pprism.x, oscdft_et.x (oscdft)
• PHonon: ph.x, dynmat.x, matdyn.x, postahc.x, q2r.x, d3hess.x
• PWneb: neb.x
• CP: cp.x, cppp.x
• TurboTDDFT: turbo_lanczos.x, turbo_spectrum.x, turbo_davidson.x
• TurboMAGNON: turbo_magnon.x
• TurboEELS: turbo_eels.x
• XSpectra: xspectra.x (spectra correction, spectra manipulation)
• atomic: ld1.x
• QEHeat: all_currents.x
• KCW: kcw.x

Post-Processings:

• pp.x
• dos.x
• bands.x
• band_interpolation.x
• projwfc.x
• molecularpdos.x
• ppp.x
• ppacf.x
• oscdft_pp.x
• importexport_binary.x
• pw2wannier90.x

Other executables have a brief documentation in the header of the main *.f90 file. For other packages please refer to their respective user documentation.

Last updated: June 2024