Port details |
- fleur FLAPW code for atomic computations in quantum chemistry and physics
- 5.1.20220103_2 science
=0 5.1.20220103_2Version of this port present on the latest quarterly branch. - Maintainer: yuri@FreeBSD.org
 - Port Added: 2018-09-02 21:10:54
- Last Update: 2022-04-10 19:11:41
- Commit Hash: d63665f
- License: MIT
- Description:
- The FLAPW-Method (Full Potential Linearized Augmented Plane Wave Method) is an
all-electron method which within density functional theory is universally
applicable to all atoms of the periodic table and to systems with compact
as well as open structures. It is widely considered to be the most precise
electronic structure method in solid state physics.
WWW: http://www.flapw.de/pm/index.php
- SVNWeb : git : Homepage
- pkg-plist: as obtained via:
make generate-plist - Dependency lines:
-
- To install the port:
- cd /usr/ports/science/fleur/ && make install clean
- To add the package, run one of these commands:
- pkg install science/fleur
- pkg install fleur
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.- PKGNAME: fleur
- Flavors: there is no flavor information for this port.
- distinfo:
- TIMESTAMP = 1641371174
SHA256 (fleur-fleur-0d3b9c4b71dc42ec0ba60fe5c6d2fce212e6fcd4_GL0.tar.gz) = 5de9c06f283db361764fe3e278c4840576d63f0c4742c9499fcaa537f97b3f0f
SIZE (fleur-fleur-0d3b9c4b71dc42ec0ba60fe5c6d2fce212e6fcd4_GL0.tar.gz) = 53095199
- Packages (timestamps in pop-ups are UTC):
- Dependencies
- NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
- Build dependencies:
-
- cmake : devel/cmake
- gfortran10 : lang/gcc10
- as : devel/binutils
- Runtime dependencies:
-
- gfortran10 : lang/gcc10
- Library dependencies:
-
- liblapack.so : math/lapack
- libopenblas.so : math/openblas
- libmpich.so : net/mpich
- libscalapack.so : math/scalapack
- libwannier.so : science/wannier90
- libxml2.so : textproc/libxml2
- There are no ports dependent upon this port
- Configuration Options:
- ===> The following configuration options are available for fleur-5.1.20220103_2:
ELPA=off: Use libelpa, Eigenvalue SoLver for Petaflop Applications
HDF5=off: HDF-5 data format support
MPI=on: MPI (Message Passing Interface) support
SCALAPACK=on: Use the ScaLAPACK Scalable LAPACK library
WANNIER=on: Use Wannier library
===> Use 'make config' to modify these settings
- Options name:
- science_fleur
- USES:
- cmake:noninja fortran gnome localbase:ldflags shebangfix tar:tgz
- FreshPorts was unable to extract/find any pkg message
- Master Sites:
|
Commit History - (may be incomplete: see SVNWeb link above for full details) |
Date | By | Description |
10 Apr 2022 19:11:41 5.1.20220103_2
|
Charlie Li (vishwin)  |
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) |
26 Mar 2022 08:27:27 5.1.20220103_1
|
Matthias Fechner (mfechner)  |
textproc/libxml2: bump all dependencies
This should make sure that all dependent ports will pick
up the new version commited with a13ec21cd733f67a9fc0dc00ab45268bdc236246 |
20 Mar 2022 18:21:02 5.1.20220103
|
Yuri Victorovich (yuri)  |
science/fleur: Broken on aarch64
Reported by: fallout |
05 Jan 2022 19:55:01 5.1.20220103
|
Yuri Victorovich (yuri)  |
science/fleur: Fix typo in USES |
05 Jan 2022 09:40:35 5.1.20220103
|
Yuri Victorovich (yuri)  |
science/fleur: Re-add port: FLAPW code for atomic computations in quantum
chemistry and physics |
27 Aug 2020 11:25:47
0.27.3_9
|
rene  |
Remove expired ports:
2020-08-26 audio/timidity++-tcltk: Broken for more than 6 months
2020-08-26 biology/pbcopper: Broken for more than 6 months
2020-08-26 devel/ace: Broken for more than 6 months
2020-08-26 devel/bin86: Broken for more than 6 months
2020-08-26 devel/erlang-oserl: Broken for more than 6 months
2020-08-20 emulators/qemu40: Please consider using qemu or qemu41
2020-08-26 games/linux-darwinia-demo: Broken for more than 6 months
2020-08-26 games/linux-defcon: Broken for more than 6 months
2020-08-26 games/linux-uplink-demo: Broken for more than 6 months
2020-08-26 games/xevil: Broken for more than 6 months
2020-08-26 games/xminesweep: Broken for more than 6 months
2020-08-26 graphics/backfract: Broken for more than 6 months
2020-08-26 japanese/kanjipad: Broken for more than 6 months (Only the first 15 lines of the commit message are shown above ) |
26 Jul 2020 07:32:00
0.27.3_9
|
antoine  |
Deprecate ports broken for more than 6 months |
06 May 2020 16:11:15
0.27.3_9
|
yuri  |
Bump 46 ports depending on math/openblas because the after the recent
math/openblas update the library name changed in openblas. |
30 Jan 2020 14:17:44
0.27.3_8
|
swills  |
Fix math/openblas and bump dependent ports
* Fix build on i386 [1]
* Fix science/code_saturne build with new openblas [2]
* Avoid installing private headers [3]
* Prevent build from optimizing for host by correcting build confg [4]
* Bump portrevision of dependent ports [5]
This is correcting issues from r523749 [1][2][4] and r515970 [3]
PR: 231371
Reported by: build cluster [1]
Reported by: Dima Pasechnik <dimpase+freebsd@gmail.com> [2]
Reported by: many [5]
Reviewed by: mat, bapt
Approved by: implicit, since this is a build fix |
06 Jan 2020 12:57:03
0.27.3_7
|
adridg  |
Update devel/cmake to latest upstream release, 3.16.2
This new release has support for the latest Boost, Objective-C
and various small improvements. The release notes are at:
https://cmake.org/cmake/help/v3.16/release/3.16.html
Two ports could not be persuaded to build with this new release
(math/openmesh science/fleur) and are marked BROKEN. Other build
fixes have already been done in-tree.
Thanks antoine@ for the exp-runs (multiple).
Thanks tcberner@ for prep-work (most of the work, actually).
PR: 242254 |
06 Oct 2019 08:37:07
0.27.3_7
|
tobik  |
science/fleur: Spell HDF5_CMAKE_ON correctly
Untested since the option is marked as broken. |
26 Jul 2019 20:46:57
0.27.3_7
|
gerald  |
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 |
22 Apr 2019 13:16:34
0.27.3_6
|
gerald  |
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 |
05 Jan 2019 22:46:54
0.27.3_5
|
sunpoet  |
Update science/hdf5 to 1.10.4
- Bump PORTREVISION of dependent ports for shlib change
Changes: https://portal.hdfgroup.org/display/support/HDF5%201.10.4#releasenotes
PR: 233070
Submitted by: wen |
25 Dec 2018 20:25:40
0.27.3_4
|
tcberner  |
Change cmake default behaviour to outsource.
Ports that build out of source now simply can use "USES=cmake"
instead of "USES=cmake:outsource". Ports that fail to build
out of source now need to specify "USES=cmake:insource".
I tried to only set insource where explictely needed.
PR: 232038
Exp-run by: antoine |
12 Dec 2018 01:35:36
0.27.3_4
|
gerald  |
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 |
22 Sep 2018 16:36:38
0.27.3_3
|
yuri  |
Change 20 ports from net/mpich2 to net/mpich
mpich2 is the obsolete version 2.x, mpich is at the current version 3.x
Ports:
math/scalapack science/nwchem science/quantum-espresso science/qmcpack
science/madness
science/qbox science/openmx science/jdftx science/fleur science/libgridxc
science/mdynamix science/lm science/dftbplus science/py-gpaw devel/ga
math/elpa net/charm science/gromacs math/pari math/arpack-ng-mpich |
03 Sep 2018 07:35:04
0.27.3_2
|
yuri  |
science/fleur: Add the forgotten patches. |
03 Sep 2018 04:10:18
0.27.3_2
|
yuri  |
science/fleur: Add WANNIER option to use Wannier library |
03 Sep 2018 01:09:21
0.27.3_1
|
yuri  |
science/fleur: Add port options for libraries: mpi, scalapack, elpa, hdf5 |
02 Sep 2018 21:10:30
0.27.3
|
yuri  |
New port: science/fleur: FLAPW code for atomic computations in quantum chemistry
and physics |