Port details on branch 2022Q3 |
- octopus Scientific program aimed at the ab initio virtual experimentation
- 13.0_2 science =0 13.0_2Version of this port present on the latest quarterly branch.
- Maintainer: yuri@FreeBSD.org
- Port Added: 2018-08-24 17:54:24
- Last Update: 2024-03-21 17:10:16
- Commit Hash: 496e64e
- License: GPLv2
- WWW:
- https://octopus-code.org/new-site/main/
- Description:
- Octopus is a scientific program aimed at the ab initio virtual experimentation
on a hopefully ever-increasing range of system types. Electrons are described
quantum-mechanically within density-functional theory (DFT), in its
time-dependent form (TDDFT) when doing simulations in time. Nuclei are described
classically as point particles. Electron-nucleus interaction is described within
the pseudopotential approximation.
For optimal execution performance Octopus is parallelized using MPI and OpenMP
and can scale to tens of thousands of processors. It also has support for
graphical processing units (GPUs) through OpenCL and CUDA.
- ¦ ¦ ¦ ¦
- Manual pages:
- FreshPorts has no man page information for this port.
- pkg-plist: as obtained via:
make generate-plist - Dependency lines:
-
- octopus>0:science/octopus
- To install the port:
- cd /usr/ports/science/octopus/ && make install clean
- To add the package, run one of these commands:
- pkg install science/octopus
- pkg install octopus
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.- PKGNAME: octopus
- Flavors: there is no flavor information for this port.
- distinfo:
- TIMESTAMP = 1699299691
SHA256 (octopus-13.0.tar.gz) = b4d0fd496c31a9c4aa4677360e631765049373131e61f396b00048235057aeb1
SIZE (octopus-13.0.tar.gz) = 43659771
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:
-
- bash : shells/bash
- gfortran13 : lang/gcc13
- gmake>=4.4.1 : devel/gmake
- python3.9 : lang/python39
- as : devel/binutils
- perl5>=5.36<5.37 : lang/perl5.36
- Test dependencies:
-
- python3.9 : lang/python39
- Runtime dependencies:
-
- gfortran13 : lang/gcc13
- python3.9 : lang/python39
- perl5>=5.36<5.37 : lang/perl5.36
- Library dependencies:
-
- libarpack.so : math/arpack-ng
- libblas.so : math/blas
- libfftw3.so : math/fftw3
- libfontconfig.so : x11-fonts/fontconfig
- libfreetype.so : print/freetype2
- libgd.so : graphics/gd
- libgmp.so : math/gmp
- libgsl.so : math/gsl
- liblapack.so : math/lapack
- libmpfr.so : math/mpfr
- libnlopt.so : math/nlopt
- libpng.so : graphics/png
- libsymspg.so : science/spglib
- libtiff.so : graphics/tiff
- libvdwxcfort.so : science/libvdwxc
- libwebp.so : graphics/webp
- libxc.so : science/libxc
- libyaml.so : textproc/libyaml
- libjpeg.so : graphics/jpeg-turbo
- There are no ports dependent upon this port
Configuration Options:
- ===> The following configuration options are available for octopus-13.0_2:
OPENMP=on: Parallel processing support via OpenMP
===> Use 'make config' to modify these settings
- Options name:
- science_octopus
- USES:
- compiler:c++14-lang fortran gmake jpeg libtool localbase:ldflags perl5 python shebangfix
- FreshPorts was unable to extract/find any pkg message
- Master Sites:
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