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Port details
qwalk Quantum Monte Carlo package for quantum chemistry computations
1.0.1.300_6 science on this many watch lists=0 search for ports that depend on this port Find issues related to this port Report an issue related to this port View this port on Repology. pkg-fallout 1.0.1.300_6Version of this port present on the latest quarterly branch.
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2018-08-21 04:31:32
Last Update: 2023-07-08 01:01:44
Commit Hash: e81dafc
License: GPLv2
WWW:
https://qwalk.github.io/mainline/
Description:
QWalk is a program developed to perform high accuracy quantum Monte Carlo calculations of electronic structure in molecules and solids. It is specifically designed as a research vehicle for new algorithms and method developments, as well as being able to scale up to large system sizes.
Homepage    cgit ¦ Codeberg ¦ GitHub ¦ GitLab ¦ SVNWeb

Manual pages:
FreshPorts has no man page information for this port.
pkg-plist: as obtained via: make generate-plist
Expand this list (16 items)
Collapse this list.
  1. /usr/local/share/licenses/qwalk-1.0.1.300_6/catalog.mk
  2. /usr/local/share/licenses/qwalk-1.0.1.300_6/LICENSE
  3. /usr/local/share/licenses/qwalk-1.0.1.300_6/GPLv2
  4. bin/abinit2qmc
  5. bin/crystal2qmc
  6. bin/g032qmc
  7. bin/gamess2qmc
  8. bin/gamessci2qmc
  9. bin/gosling
  10. bin/heg2qmc
  11. bin/nwchem2qmc
  12. bin/qwalk
  13. bin/siesta2qmc
  14. @owner
  15. @group
  16. @mode
Collapse this list.
Dependency lines:
  • qwalk>0:science/qwalk
To install the port:
cd /usr/ports/science/qwalk/ && make install clean
To add the package, run one of these commands:
  • pkg install science/qwalk
  • pkg install qwalk
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.
PKGNAME: qwalk
Flavors: there is no flavor information for this port.
distinfo:
TIMESTAMP = 1534830462 SHA256 (QWalk-mainline-v1.0.1-300-g1b7e381_GH0.tar.gz) = 4d33a16cc0ad9ec3ca339b102f2a16cb6a70609212d06c19c75163547f0282f7 SIZE (QWalk-mainline-v1.0.1-300-g1b7e381_GH0.tar.gz) = 980771

Packages (timestamps in pop-ups are UTC):
qwalk
ABIaarch64amd64armv6armv7i386powerpcpowerpc64powerpc64le
FreeBSD:13:latest1.0.1.300_61.0.1.300_61.0.1.300_31.0.1.300_61.0.1.300_6-1.0.1.300_3-
FreeBSD:13:quarterly1.0.1.300_61.0.1.300_6-1.0.1.300_61.0.1.300_6-1.0.1.300_61.0.1.300_6
FreeBSD:14:latest1.0.1.300_61.0.1.300_6-1.0.1.300_61.0.1.300_6---
FreeBSD:14:quarterly1.0.1.300_61.0.1.300_6-1.0.1.300_61.0.1.300_6-1.0.1.300_61.0.1.300_6
FreeBSD:15:latest1.0.1.300_61.0.1.300_6n/a1.0.1.300_6n/a-1.0.1.300_61.0.1.300_6
Dependencies
NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
Build dependencies:
  1. gfortran12 : lang/gcc12
  2. gmake>=4.3 : devel/gmake
  3. as : devel/binutils
  4. perl5>=5.32.r0<5.33 : lang/perl5.32
Runtime dependencies:
  1. gfortran12 : lang/gcc12
  2. perl5>=5.32.r0<5.33 : lang/perl5.32
Library dependencies:
  1. libxml2.so : textproc/libxml2
There are no ports dependent upon this port

Configuration Options:
No options to configure
Options name:
science_qwalk
USES:
compiler:c++11-lang fortran gmake gnome perl5
FreshPorts was unable to extract/find any pkg message
Master Sites:
Expand this list (1 items)
Collapse this list.
  1. https://codeload.github.com/QWalk/mainline/tar.gz/v1.0.1-300-g1b7e381?dummy=/
Collapse this list.

Number of commits found: 15

Commit History - (may be incomplete: for full details, see links to repositories near top of page)
CommitCreditsLog message
1.0.1.300_6
08 Jul 2023 01:01:44
commit hash: e81dafc952d7bb8c3d22c5aa0eb1816626d4352dcommit hash: e81dafc952d7bb8c3d22c5aa0eb1816626d4352dcommit hash: e81dafc952d7bb8c3d22c5aa0eb1816626d4352dcommit hash: e81dafc952d7bb8c3d22c5aa0eb1816626d4352d files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/qwalk: Fix build on 14 by adding c++11
1.0.1.300_6
23 Apr 2023 09:09:58
commit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5bcommit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5bcommit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5bcommit hash: 8d3e020ed032a8db00208994d0db646de7dc6f5b files touched by this commit
Gerald Pfeifer (gerald) search for other commits by this committer
*: Bump PORTREVISIONs for math/mpc update to 1.3.1
07 Sep 2022 21:58:51
commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash: fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4 files touched by this commit
Stefan Eßer (se) search for other commits by this committer
Remove WWW entries moved into port Makefiles

Commit b7f05445c00f has added WWW entries to port Makefiles based on
WWW: lines in pkg-descr files.

This commit removes the WWW: lines of moved-over URLs from these
pkg-descr files.

Approved by:		portmgr (tcberner)
1.0.1.300_5
07 Sep 2022 21:10:59
commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash: b7f05445c00f2625aa19b4154ebcbce5ed2daa52 files touched by this commit
Stefan Eßer (se) search for other commits by this committer
Add WWW entries to port Makefiles

It has been common practice to have one or more URLs at the end of the
ports' pkg-descr files, one per line and prefixed with "WWW:". These
URLs should point at a project website or other relevant resources.

Access to these URLs required processing of the pkg-descr files, and
they have often become stale over time. If more than one such URL was
present in a pkg-descr file, only the first one was tarnsfered into
the port INDEX, but for many ports only the last line did contain the
port specific URL to further information.

There have been several proposals to make a project URL available as
a macro in the ports' Makefiles, over time.
(Only the first 15 lines of the commit message are shown above View all of this commit message)
1.0.1.300_5
10 Apr 2022 19:11:41
commit hash: d63665f7cd9c99880704a3c5bc221829cb009744commit hash: d63665f7cd9c99880704a3c5bc221829cb009744commit hash: d63665f7cd9c99880704a3c5bc221829cb009744commit hash: d63665f7cd9c99880704a3c5bc221829cb009744 files touched by this commit
Charlie Li (vishwin) search for other commits by this committer
textproc/libxml2: bump all LIB_DEPENDS consumers

This is a separate commit to facilitate easier cherry-picking for
quarterly.

PR: 262853, 262940, 262877, 263126
Approved by: fluffy (mentor)
1.0.1.300_4
26 Mar 2022 08:27:27
commit hash: 247c7db7513f1264922428278678da641c5a3f52commit hash: 247c7db7513f1264922428278678da641c5a3f52commit hash: 247c7db7513f1264922428278678da641c5a3f52commit hash: 247c7db7513f1264922428278678da641c5a3f52 files touched by this commit
Matthias Fechner (mfechner) search for other commits by this committer
textproc/libxml2: bump all dependencies

This should make sure that all dependent ports will pick
up the new version commited with a13ec21cd733f67a9fc0dc00ab45268bdc236246
1.0.1.300_3
07 Apr 2021 08:09:01
commit hash: cf118ccf875508b9a1c570044c93cfcc82bd455ccommit hash: cf118ccf875508b9a1c570044c93cfcc82bd455ccommit hash: cf118ccf875508b9a1c570044c93cfcc82bd455ccommit hash: cf118ccf875508b9a1c570044c93cfcc82bd455c files touched by this commit
Mathieu Arnold (mat) search for other commits by this committer
One more small cleanup, forgotten yesterday.
Reported by:	lwhsu
1.0.1.300_3
06 Apr 2021 14:31:07
commit hash: 305f148f482daf30dcf728039d03d019f88344ebcommit hash: 305f148f482daf30dcf728039d03d019f88344ebcommit hash: 305f148f482daf30dcf728039d03d019f88344ebcommit hash: 305f148f482daf30dcf728039d03d019f88344eb files touched by this commit
Mathieu Arnold (mat) search for other commits by this committer
Remove # $FreeBSD$ from Makefiles.
1.0.1.300_3
26 Jul 2019 20:46:57
Revision:507372Original commit files touched by this commit
gerald search for other commits by this committer
Bump PORTREVISION for ports depending on the canonical version of GCC
as defined in Mk/bsd.default-versions.mk which has moved from GCC 8.3
to GCC 9.1 under most circumstances now after revision 507371.

This includes ports
 - with USE_GCC=yes or USE_GCC=any,
 - with USES=fortran,
 - using Mk/bsd.octave.mk which in turn features USES=fortran, and
 - with USES=compiler specifying openmp, nestedfct, c11, c++0x, c++11-lang,
   c++11-lib, c++14-lang, c++17-lang, or gcc-c++11-lib
plus, everything INDEX-11 shows with a dependency on lang/gcc9 now.

PR:		238330
1.0.1.300_2
22 Apr 2019 13:16:34
Revision:499638Original commit files touched by this commit
gerald search for other commits by this committer
Related to revision 499061 bump ports with USES=fortran to have them
benefit from the improved situation where libgcc_s is only used when
absolutely necessary.

Suggested by:	tijl
1.0.1.300_1
18 Dec 2018 08:43:53
Revision:487736Original commit files touched by this commit
yuri search for other commits by this committer
science/qwalk: Fix build with GCC-based architectures

Also add USES=gnome.

PR:		234115
Submitted by:	Piotr Kubaj <pkubaj@anongoth.pl>
1.0.1.300_1
12 Dec 2018 01:35:36
Revision:487272Original commit files touched by this commit
gerald search for other commits by this committer
Bump PORTREVISION for ports depending on the canonical version of GCC
defined via Mk/bsd.default-versions.mk which has moved from GCC 7.4 t
GCC 8.2 under most circumstances.

This includes ports
 - with USE_GCC=yes or USE_GCC=any,
 - with USES=fortran,
 - using Mk/bsd.octave.mk which in turn features USES=fortran, and
 - with USES=compiler specifying openmp, nestedfct, c11, c++0x, c++11-lang,
   c++11-lib, c++14-lang, c++17-lang, or gcc-c++11-lib
plus, as a double check, everything INDEX-11 showed depending on lang/gcc7.

PR:		231590
1.0.1.300
30 Aug 2018 17:50:38
Revision:478476Original commit files touched by this commit
yuri search for other commits by this committer
science/qwalk: Add PORTSCOUT=limit

Reported by:	portscout
1.0.1.300
21 Aug 2018 05:50:51
Revision:477706Original commit files touched by this commit
yuri search for other commits by this committer
science/qwalk: Correct the version: it is 1.0.1-300
g20170426
21 Aug 2018 04:31:20
Revision:477701Original commit files touched by this commit
yuri search for other commits by this committer
New port: science/qwalk: Quantum Monte Carlo package for quantum chemistry
computations

Number of commits found: 15