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Name: quantum-espresso | Distribution: Fedora Project |
Version: 5.4.0 | Vendor: Fedora Project |
Release: 10.el7 | Build date: Sun Sep 18 04:15:27 2016 |
Group: Unspecified | Build host: buildppc-04.phx2.fedoraproject.org |
Size: 141538063 | Source RPM: quantum-espresso-5.4.0-10.el7.src.rpm |
Packager: Fedora Project | |
Url: http://www.quantum-espresso.org/ | |
Summary: A suite for electronic-structure calculations and materials modeling |
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.
GPLv2+
* Fri Sep 16 2016 Marcin Dulak <Marcin.Dulak@gmail.com> - 5.4.0-10 - upsteam update - speedup the tests by running on single core so koji %{arm} builds finish within the timeout (bug #1356620) - get rid of D__XLF and D__LINUX_ESSL on ppc64 * Tue Sep 06 2016 Peter Robinson <pbrobinson@fedoraproject.org> 5.3.0-9 - Sync openblas ExclusiveArch * Thu Feb 18 2016 Marcin Dulak <Marcin.Dulak@gmail.com> - 5.3.0-8 - use only 2 cores for tests (bug #1308481) - defattr removed * Sat Feb 13 2016 Marcin Dulak <Marcin.Dulak@gmail.com> - 5.3.0-7 - explicit Requires are needed for scalapack, blacs on el6 (bug #1301922) * Thu Feb 04 2016 Fedora Release Engineering <releng@fedoraproject.org> - 5.3.0-6 - Rebuilt for https://fedoraproject.org/wiki/Fedora_24_Mass_Rebuild * Tue Jan 12 2016 Marcin Dulak <Marcin.Dulak@gmail.com> 5.3.0-5 - upsteam update - switch to test-suite - no more upftools? * Mon Jan 04 2016 Marcin Dulak <Marcin.Dulak@gmail.com> 5.2.1-4 - disable compilation warnings - use lua for copying pseudos - removed common package * Sat Dec 19 2015 Marcin Dulak <Marcin.Dulak@gmail.com> 5.2.1-3 - fix ExclusiveArch - license is GPLv2+ - OMP_NUM_THREADS removed - use %{optflags} * Fri Dec 18 2015 Dave Love <loveshack@fedoraproject.org> - 5.2.1-2 - Require %{name}-common, not %{name}-common%{?_isa} * Wed Dec 16 2015 Marcin Dulak <Marcin.Dulak@gmail.com> 5.1.2-1 - initial build
/usr/bin/average.x /usr/bin/bands.x /usr/bin/bgw2pw.x /usr/bin/bse_main.x /usr/bin/casino2upf.x /usr/bin/cp.x /usr/bin/cpmd2upf.x /usr/bin/cppp.x /usr/bin/d3.x /usr/bin/dist.x /usr/bin/dos.x /usr/bin/dynmat.x /usr/bin/epsilon.x /usr/bin/ev.x /usr/bin/fd.x /usr/bin/fd_ef.x /usr/bin/fd_ifc.x /usr/bin/fhi2upf.x /usr/bin/fpmd2upf.x /usr/bin/fqha.x /usr/bin/fs.x /usr/bin/generate_rVV10_kernel_table.x /usr/bin/generate_vdW_kernel_table.x /usr/bin/gww.x /usr/bin/gww_fit.x /usr/bin/head.x /usr/bin/importexport_binary.x /usr/bin/initial_state.x /usr/bin/interpolate.x /usr/bin/iotk /usr/bin/iotk.x /usr/bin/iotk_print_kinds.x /usr/bin/kpoints.x /usr/bin/lambda.x /usr/bin/ld1.x /usr/bin/manycp.x /usr/bin/manypw.x /usr/bin/matdyn.x /usr/bin/molecularpdos.x /usr/bin/ncpp2upf.x /usr/bin/neb.x /usr/bin/oldcp2upf.x /usr/bin/path_interpolation.x /usr/bin/ph.x /usr/bin/phcg.x /usr/bin/plan_avg.x /usr/bin/plotband.x /usr/bin/plotproj.x /usr/bin/plotrho.x /usr/bin/pmw.x /usr/bin/pp.x /usr/bin/projwfc.x /usr/bin/pw.x /usr/bin/pw2bgw.x /usr/bin/pw2gw.x /usr/bin/pw2wannier90.x /usr/bin/pw4gww.x /usr/bin/pw_export.x /usr/bin/pwcond.x /usr/bin/pwi2xsf.x /usr/bin/q2qstar.x /usr/bin/q2r.x /usr/bin/q2trans.x /usr/bin/q2trans_fd.x /usr/bin/read_upf_tofile.x /usr/bin/rrkj2upf.x /usr/bin/spectra_manipulation.x /usr/bin/sumpdos.x /usr/bin/turbo_davidson.x /usr/bin/turbo_eels.x /usr/bin/turbo_lanczos.x /usr/bin/turbo_spectrum.x /usr/bin/upf2casino.x /usr/bin/uspp2upf.x /usr/bin/vdb2upf.x /usr/bin/virtual.x /usr/bin/wannier_ham.x /usr/bin/wannier_plot.x /usr/bin/wfck2r.x /usr/bin/wfdd.x /usr/bin/xspectra.x /usr/share/licenses/quantum-espresso-5.4.0 /usr/share/licenses/quantum-espresso-5.4.0/License /usr/share/licenses/quantum-espresso-5.4.0/README
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