| Port details on branch 2022Q3 |
- fleur FLAPW code for atomic computations in quantum chemistry and physics
- 6.2_3 science
 =0      6.2_3Version of this port present on the latest quarterly branch. - Maintainer: yuri@FreeBSD.org
- Port Added: 2018-09-02 21:10:54
- Last Update: 2024-01-01 11:49:51
- Commit Hash: f2489ab
- License: MIT
- WWW:
- https://www.flapw.de/master/
- 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.
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- Manual pages:
- FreshPorts has no man page information for this port.
- pkg-plist: as obtained via:
make generate-plist - Dependency lines:
-
- Conflicts:
- CONFLICTS_BUILD:
- Conflicts Matches:
-
There are no Conflicts Matches for this port. This is usually an error.
- 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 = 1690334658
SHA256 (fleur-fleur-a9f84b504efcb04c6d5bd2f59b6b1a0f9eb6e831_GL0.tar.gz) = ff0898becbb5333471b20770ac22a0f3a7b3ccc2fc8c5746222519db991e9a07
SIZE (fleur-fleur-a9f84b504efcb04c6d5bd2f59b6b1a0f9eb6e831_GL0.tar.gz) = 50969349
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-core
- gfortran12 : lang/gcc12
- as : devel/binutils
- Test dependencies:
-
- py39-pytest>0 : devel/py-pytest@py39
- python3.9 : lang/python39
- Runtime dependencies:
-
- gfortran12 : lang/gcc12
- Library dependencies:
-
- libfftw3.so : math/fftw3
- libhdf5.so : science/hdf5
- liblapack.so : math/lapack
- libopenblas.so : math/openblas
- libelpa.so : math/elpa
- 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-6.2_3:
ELPA=on: Use libelpa, Eigenvalue SoLver for Petaflop Applications
HDF5=off: HDF-5 data format support
KPLIB=off: Use kpLib library
LIBXC=off: Use libxc library
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 python:test tar:tgz
- FreshPorts was unable to extract/find any pkg message
- Master Sites:
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