Package: abinit (9.2.2-1)
Links for abinit
Debian Resources:
Download Source Package abinit:
Maintainers:
External Resources:
- Homepage [www.abinit.org]
Similar packages:
package for electronic structure calculations
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 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. Excited states can be computed within the Time-Dependent Density Functional Theory (for molecules), or within Many-Body Perturbation Theory (the GW approximation). In addition to the main ABINIT code, different utility programs are provided.
This package contains the executables needed to perform calculations (however, pseudopotentials are not supplied). For a set of pseudopotentials, install the abinit-data package.
Other Packages Related to abinit
|
|
|
|
-
- dep: libblas3
- Basic Linear Algebra Reference implementations, shared library
- or libblas.so.3
- virtual package provided by libatlas3-base, libblas3, libblis3-openmp, libblis3-pthread, libblis3-serial, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial
-
- dep: libc6 (>= 2.29)
- GNU C Library: Shared libraries
also a virtual package provided by libc6-udeb
-
- dep: libgcc-s1 (>= 4.0) [not i386, mipsel]
- GCC support library
- dep: libgcc-s1 (>= 4.2) [mipsel]
- dep: libgcc-s1 (>= 7) [i386]
-
- dep: libgfortran5 (>= 10)
- Runtime library for GNU Fortran applications
-
- dep: liblapack3
- Library of linear algebra routines 3 - shared version
- or liblapack.so.3
- virtual package provided by libatlas3-base, liblapack3, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial
-
- dep: libnetcdff7 (>= 4.1.1)
- Fortran interface for scientific data access to large binary data
-
- dep: libopenmpi3 (>= 4.1.0)
- high performance message passing library -- shared library
-
- dep: libxc5 (>= 4.2.1)
- Library of Exchange-Correlation Functionals
-
- dep: mpi-default-bin
- Standard MPI runtime programs (metapackage)
-
- rec: abinit-data
- package for electronic structure calculations (Data files)
-
- sug: abinit-doc
- package for electronic structure calculations (Documentation)
Download abinit
| Architecture | Package Size | Installed Size | Files |
|---|---|---|---|
| amd64 | 26,126.9 kB | 159,787.0 kB | [list of files] |
| arm64 | 22,826.6 kB | 138,567.0 kB | [list of files] |
| armel | 24,195.2 kB | 154,585.0 kB | [list of files] |
| armhf | 22,302.8 kB | 122,842.0 kB | [list of files] |
| i386 | 25,430.7 kB | 166,289.0 kB | [list of files] |
| mips64el | 21,568.3 kB | 153,632.0 kB | [list of files] |
| mipsel | 22,607.2 kB | 155,733.0 kB | [list of files] |
| ppc64el | 26,050.0 kB | 158,855.0 kB | [list of files] |
| s390x | 22,206.2 kB | 153,013.0 kB | [list of files] |