[ol8_developer_EPEL] quantum-espresso-6.5-2.el8.x86_64

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.

Serial version. Includes iotk executables.

Filelist (Show Changelog) (Show related packages)

• /

  • usr

    • bin

      • alpha2f.x

      • average.x

      • bands.x

      • benchmark_libxc.x

      • bse_main.x

      • casino2upf.x

      • cell2ibrav.x

      • cp.x

      • cpmd2upf.x

      • cppp.x

      • dist.x

      • dos.x

      • dynmat.x

      • epa.x

      • epsilon.x

      • ev.x

      • extract_core.x

      • fd.x

      • fd_ef.x

      • fd_ifc.x

      • fermi_proj.x

      • fermi_velocity.x

      • fhi2upf.x

      • fix_upf.x

      • fpmd2upf.x

      • fqha.x

      • fs.x

      • gww.x

      • gww_fit.x

      • head.x

      • hp.x

      • ibrav2cell.x

      • initial_state.x

      • interpolate.x

      • iotk

      • iotk.x

      • iotk_print_kinds.x

      • kpoints.x

      • lambda.x

      • ld1.x

      • manycp.x

      • manypw.x

      • matdyn.x

      • molecularnexafs.x

      • molecularpdos.x

      • ncpp2upf.x

      • neb.x

      • oldcp2upf.x

      • open_grid.x

      • path_interpolation.x

      • ph.x

      • phcg.x

      • plan_avg.x

      • plotband.x

      • plotproj.x

      • plotrho.x

      • pmw.x

      • pp.x

      • ppacf.x

      • projwfc.x

      • pw.x

      • pw2bgw.x

      • pw2critic.x

      • pw2gw.x

      • pw2wannier90.x

      • pw4gww.x

      • pwcond.x

      • pwi2xsf.x

      • q2qstar.x

      • q2r.x

      • q2trans.x

      • q2trans_fd.x

      • read_upf_tofile.x

      • rrkj2upf.x

      • simple.x

      • simple_bse.x

      • simple_ip.x

      • spectra_correction.x

      • sumpdos.x

      • turbo_davidson.x

      • turbo_eels.x

      • turbo_lanczos.x

      • turbo_spectrum.x

      • upf2casino.x

      • uspp2upf.x

      • vdb2upf.x

      • virtual_v2.x

      • wannier_ham.x

      • wannier_plot.x

      • wfck2r.x

      • wfdd.x

      • xspectra.x

    • lib

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