quantum-espresso

Quantum ESPRESSO is an integrated suite of Open-Source computer codes for electronic-structure calculations and materials modeling at the nanoscale. It is based on density-functional theory, plane waves, and pseudopotentials.

Name
quantum-espresso
Programs
  • ZG.x
  • abcoeff_to_eps.x
  • all_currents.x
  • alpha2f.x
  • average.x
  • bands.x
  • bands_unfold.x
  • bse_main.x
  • casino2upf.x
  • cell2ibrav.x
  • cp.x
  • cppp.x
  • d3hess.x
  • disca.x
  • dos.x
  • dos_sp.x
  • dvscf_q2r.x
  • dynmat.x
  • ef.x
  • epa.x
  • epsilon.x
  • epsilon_Gaus.x
  • epw.x
  • epw_pp.py
  • ev.x
  • fd.x
  • fd_ef.x
  • fd_ifc.x
  • fermi_int_0.x
  • fermi_int_1.x
  • fermi_proj.x
  • fermi_velocity.x
  • fqha.x
  • fs.x
  • graph.x
  • gww.x
  • gww_fit.x
  • head.x
  • hgh2qe.x
  • hp.x
  • ibrav2cell.x
  • initial_state.x
  • kcw.x
  • kcwpp_interp.x
  • kcwpp_sh.x
  • kpoints.x
  • lambda.x
  • ld1.x
  • manycp.x
  • matdyn.x
  • memory_pw4gww.x
  • merge_wann.x
  • molecularnexafs.x
  • molecularpdos.x
  • neb.x
  • open_grid.x
  • path_interpolation.x
  • pawplot.x
  • ph.x
  • phcg.x
  • plan_avg.x
  • plotband.x
  • plotproj.x
  • plotrho.x
  • pmw.x
  • postahc.x
  • pp.x
  • pp_disca.x
  • pp_spctrlfn.x
  • ppacf.x
  • pprism.x
  • projwfc.x
  • pw.x
  • pw2bgw.x
  • pw2critic.x
  • pw2gt.x
  • pw2gw.x
  • pw2qmcpack.x
  • pw2wannier90.x
  • pw4gww.x
  • pwcond.x
  • pwi2xsf.x
  • q2qstar.x
  • q2r.x
  • qe_xc_infos.x
  • scan_ibrav.x
  • simple.x
  • simple_bse.x
  • simple_ip.x
  • spectra_correction.x
  • sumpdos.x
  • turbo_davidson.x
  • turbo_eels.x
  • turbo_lanczos.x
  • turbo_magnon.x
  • turbo_spectrum.x
  • upfconv.x
  • virtual_v2.x
  • wannier_ham.x
  • wannier_plot.x
  • wfck2r.x
  • wfdd.x
  • xspectra.x
Homepage
Version
7.4.1
License
Maintainers
Platforms
  • x86_64-linux
  • x86_64-darwin
Defined
Source