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Port details on branch 2022Q2
abinit Full-featured atomic-scale first-principles simulation software
9.4.2_4 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 9.4.2_4Version of this port present on the latest quarterly branch.
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2022-04-24 04:16:20
Last Update: 2022-04-10 19:47:23
Commit Hash: 035e778
License: GPLv3
WWW:
https://www.abinit.org
Description:
ABINIT is a package whose main program allows one to find the total energy, charge density and electronic structure of systems made of electrons and nuclei (molecules and periodic solids) within Density Functional Theory (DFT), using pseudopotentials and a planewave or wavelet basis. ABINIT also includes options to optimize the geometry according to the DFT forces and stresses, or to perform molecular dynamics simulations using these forces, or to generate dynamical matrices, Born effective charges, and dielectric tensors, based on Density-Functional Perturbation Theory, and many more properties. Excited states can be computed within the Many-Body Perturbation Theory (the GW approximation and the Bethe-Salpeter equation), and Time-Dependent Density Functional Theory (for molecules). In addition to the main ABINIT code, different utility programs are provided. WWW: https://www.abinit.org
Homepage    cgit ¦ Codeberg ¦ GitHub ¦ GitLab ¦ SVNWeb - no subversion history for this port

Manual pages:
FreshPorts has no man page information for this port.
pkg-plist: as obtained via: make generate-plist
Expand this list (30 items)
Collapse this list.
  1. /usr/local/share/licenses/abinit-9.4.2_4/catalog.mk
  2. /usr/local/share/licenses/abinit-9.4.2_4/LICENSE
  3. /usr/local/share/licenses/abinit-9.4.2_4/GPLv3
  4. bin/abinit
  5. bin/abitk
  6. bin/aim
  7. bin/anaddb
  8. bin/atdep
  9. bin/band2eps
  10. bin/conducti
  11. bin/cut3d
  12. bin/dummy_tests
  13. bin/fftprof
  14. bin/fold2Bloch
  15. bin/ioprof
  16. bin/lapackprof
  17. bin/macroave
  18. bin/mrgddb
  19. bin/mrgdv
  20. bin/mrggkk
  21. bin/mrgscr
  22. bin/multibinit
  23. bin/optic
  24. bin/testtransposer
  25. bin/ujdet
  26. bin/vdw_kernelgen
  27. libdata/pkgconfig/abinit.pc
  28. @owner
  29. @group
  30. @mode
Collapse this list.
Dependency lines:
  • abinit>0:science/abinit
To install the port:
cd /usr/ports/science/abinit/ && make install clean
To add the package, run one of these commands:
  • pkg install science/abinit
  • pkg install abinit
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.
PKGNAME: abinit
Flavors: there is no flavor information for this port.
ONLY_FOR_ARCHS: amd64 powerpc64 powerpc64le
distinfo:
TIMESTAMP = 1620357131 SHA256 (abinit-abinit-9.4.2_GH0.tar.gz) = 345a98df01665f3ac123806a832219974a59a31cac704c984f29a744f794e8d4 SIZE (abinit-abinit-9.4.2_GH0.tar.gz) = 108668848
No package information for this port in our database
Sometimes this happens. Not all ports have packages. Perhaps there is a build error. Check the fallout link: pkg-fallout
Dependencies
NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
Build dependencies:
  1. gm4 : devel/m4
  2. py38-numpy>=1.16,1<1.21,1 : math/py-numpy@py38
  3. py38-pygments>=0 : textproc/py-pygments@py38
  4. py38-pandas>0 : math/py-pandas@py38
  5. py38-graphviz>0 : graphics/py-graphviz@py38
  6. mpich>0 : net/mpich
  7. gfortran10 : lang/gcc10
  8. gmake>=4.3 : devel/gmake
  9. python3.8 : lang/python38
  10. as : devel/binutils
  11. autoconf>=2.69 : devel/autoconf
  12. automake>=1.16.1 : devel/automake
Runtime dependencies:
  1. atompaw : science/atompaw
  2. mpich>0 : net/mpich
  3. gfortran10 : lang/gcc10
  4. python3.8 : lang/python38
Library dependencies:
  1. libelpa.so : math/elpa
  2. libsz.so : science/szip
  3. libelpa.so : math/elpa
  4. libxc.so : science/libxc
  5. libfftw3.so : math/fftw3
  6. libhdf5.so : science/hdf5
  7. libxml2.so : textproc/libxml2
  8. libnetcdf.so : science/netcdf
  9. libxmlf90.so : textproc/xmlf90
  10. libwannier.so : science/wannier90
  11. libnetcdff.so : science/netcdf-fortran
  12. libblas.so : math/blas
  13. liblapack.so : math/lapack
  14. libxml2.so : textproc/libxml2
There are no ports dependent upon this port
Configuration Options:
===> The following configuration options are available for abinit-9.4.2_4: DOCS=on: Build and/or install documentation MPI=on: MPI (Message Passing Interface) support OPENMP=on: Parallel processing support via OpenMP ===> Use 'make config' to modify these settings
Options name:
science_abinit
USES:
autoreconf:build blaslapack:netlib fortran gmake gnome localbase:ldflags python:3.7+ shebangfix
FreshPorts was unable to extract/find any pkg message
Master Sites:
Expand this list (1 items)
Collapse this list.
  1. https://codeload.github.com/abinit/abinit/tar.gz/9.4.2?dummy=/
Collapse this list.

Number of commits found: 1

Commit History - (may be incomplete: for full details, see links to repositories near top of page)
CommitCreditsLog message
9.4.2_4
10 Apr 2022 19:47:23
commit hash: 035e778ee53345464c2d7466a3895e17073ad1f6commit hash: 035e778ee53345464c2d7466a3895e17073ad1f6commit hash: 035e778ee53345464c2d7466a3895e17073ad1f6commit hash: 035e778ee53345464c2d7466a3895e17073ad1f6 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 and direct commit to quarterly as PORTREVISIONs
may not match from main.

PR: 262853, 262940, 262877
Approved by: fluffy (mentor)

Number of commits found: 1
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