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Package Details: nwchem-bin 7.2.3.10-2

Package Actions

Git Clone URL:	https://aur.archlinux.org/nwchem-bin.git (read-only, click to copy)
Package Base:	nwchem-bin
Description:	High-performance computational chemistry software (OpenMPI build) — Debian binary build
Upstream URL:	https://nwchemgit.github.io
Licenses:	GPL3, custom:ECL2.0
Conflicts:	nwchem
Provides:	nwchem
Submitter:	berquist
Maintainer:	e-kwsm
Last Packager:	e-kwsm
Votes:	2
Popularity:	0.000000
First Submitted:	2016-03-22 15:29 (UTC)
Last Updated:	2025-07-30 04:29 (UTC)

Dependencies (6)

blas (blis-cblas-openmp^AUR, blis-cblas^AUR, aocl-blis-aocc^AUR, atlas-lapack^AUR, blas-aocl-gcc^AUR, blas-aocl-aocc^AUR, blas-mkl^AUR, blas-openblas-git^AUR, aocl-blis^AUR, openblas-lapack^AUR, blas-git^AUR, blas-openblas)
lapack (aocl-libflame-aocc^AUR, atlas-lapack^AUR, blas-aocl-gcc^AUR, blas-aocl-aocc^AUR, blas-mkl^AUR, aocl-libflame^AUR, blas-openblas-git^AUR, openblas-lapack^AUR, lapack-git^AUR, blas-openblas)
nwchem-data^AUR
openmpi (openmpi-git^AUR)
python
scalapack^AUR

Required by (1)

python-qcengine (requires nwchem) (optional)

Sources (2)

Latest Comments

berquist commented on 2016-10-05 12:17 (UTC)

Well, fixed in the package download sense. It looks like they've linked this against OpenMPI 2.0, which has been flagged out-of-date on the main package list.

berquist commented on 2016-10-02 14:22 (UTC)

Fixed.

<deleted-account> commented on 2016-10-02 08:19 (UTC)

The build fails, because the file name on the ftp server changed.