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author | Nichols A. Romero <naromero77@users.noreply.github.com> | 2018-12-06 03:57:52 -0600 |
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committer | Massimiliano Culpo <massimiliano.culpo@gmail.com> | 2018-12-06 10:57:52 +0100 |
commit | 298da8e2c4784c6c9e8c6a7f9bd8c6b3a7c5b10b (patch) | |
tree | 4b6c4dd2571b46fa3d047bde8575c08f6dbf2a38 /.coveragerc | |
parent | dcb27c008a404d2be978cfc52f2bb3d153c36b49 (diff) | |
download | spack-298da8e2c4784c6c9e8c6a7f9bd8c6b3a7c5b10b.tar.gz spack-298da8e2c4784c6c9e8c6a7f9bd8c6b3a7c5b10b.tar.bz2 spack-298da8e2c4784c6c9e8c6a7f9bd8c6b3a7c5b10b.tar.xz spack-298da8e2c4784c6c9e8c6a7f9bd8c6b3a7c5b10b.zip |
Quantum ESPRESSO update - Nov 2018 (#9853)
* Add mising QE releases.
* Update QE dependencies and conflicts.
* QE 6.3 install method requires a patch to work properly.
* include QE git develop branch
* QE HDF5 needs Fortran support. HDF5 versions prior to 1.8.16 leads to QE runtime errors.
* Number of MKL related conflicts for QE.
* Flake8 fixes for QE for hdf5 lines.
* Pass in all compilers properly to QE configure
* Fixed external BLAS/LAPACK linkage in QE.
* Library search was problematic in QE.
* Add section headings to QE package.
* External FFTW compatible libraries properly detected in QE.
* Flake8 fixes for QE
* QE configure defaults to False for ELPA, thus Spack package should as well.
* QE depends on FFTW3 provider instead of FFTW explictly.
* Primary QE repo is gitlab.com, not github.com. Github mirror lags behind gitlab site.
* Support both 6.3-backports branch and develop branch in QE.
* QE patch needed for proper MKL detection. MKL_ROOT is detected and preferred, still falls back to finding first MKL installation in /opt/intel.
* Use FFTW-API provider versioned interface for specify QE FFT dependency.
* QE FFTW conflicts no longer need thanks to FFTW-API provider versioned interface.
* Flake8 3.6.0 fix in support of https://github.com/spack/spack/pull/9853
* Fix QE conflict with ilp64 variant in support of https://github.com/spack/spack/pull/9853
* Remove custom url_for_version for QE package and use builtin url instead. In support of https://github.com/spack/spack/pull/9853
* Use FFTW builtin flags for QE instead of custom Python code. In support of https://github.com/spack/spack/pull/9853
* Fix typo in QE package comments. In support of https://github.com/spack/spack/pull/9853
* Future proof QE package patches in anticipation of QE >= 6.3.1. In support of https://github.com/spack/spack/pull/9853
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