Paket: abinit (9.10.4-3 ve diğerleri)
abinit için bağlantılar
Debian Kaynakları:
- Hata Raporları
- Developer Information
- Debian Değişim Günlüğü
- Telif Hakkı Dosyası
- Debian Yama Takipçisi
abinit Kaynak Paketini İndir:
Geliştiriciler:
Dış Kaynaklar:
- Ana Sayfa [www.abinit.org]
Benzer paketler:
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.
abinit ile İlgili Diğer Paketler
|
|
|
|
-
- dep: libblas3
- Basic Linear Algebra Reference implementations, shared library
- ya da libblas.so.3
- sanal paketi sağlayan libatlas3-base, libblas3, libblis4-openmp, libblis4-pthread, libblis4-serial, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial
-
- dep: libc6 (>= 2.29) [x32]
- GNU C Library: Shared libraries
ayrıca şunun tarafından sağlanan bir sanal paket libc6-udeb
- dep: libc6 (>= 2.34) [alpha, ia64, sh4, x32 değil]
- dep: libc6 (>= 2.37) [sh4]
-
- dep: libc6.1 (>= 2.31) [ia64]
- GNU C Library: Shared libraries
ayrıca şunun tarafından sağlanan bir sanal paket libc6.1-udeb
- dep: libc6.1 (>= 2.34) [alpha]
-
- dep: libcurl4t64 (>= 7.16.2) [sparc64]
- easy-to-use client-side URL transfer library (OpenSSL flavour)
-
- dep: libevent-core-2.1-7t64 (>= 2.1.8-stable) [sparc64]
- Asynchronous event notification library (core)
-
- dep: libevent-pthreads-2.1-7t64 (>= 2.1.8-stable) [sparc64]
- Asynchronous event notification library (pthreads)
-
- dep: libgcc-s1 (>= 4.0) [hppa, i386, ia64, m68k değil]
- GCC support library
- dep: libgcc-s1 (>= 4.2) [ia64]
- dep: libgcc-s1 (>= 7) [i386]
-
- dep: libgcc-s2 (>= 4.2.1) [m68k]
- GCC support library
-
- dep: libgfortran5 (>= 10)
- Runtime library for GNU Fortran applications
-
- dep: libhdf5-103-1t64 [sparc64]
- HDF5 C runtime files - serial version
-
- dep: libhdf5-hl-100t64 [sparc64]
- HDF5 High Level runtime files - serial version
-
- dep: libhwloc15 (>= 2.10.0) [sparc64]
- Hierarchical view of the machine - shared libs
-
- dep: liblapack3
- Library of linear algebra routines 3 - shared version
- ya da liblapack.so.3
- sanal paketi sağlayan libatlas3-base, liblapack3, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial
-
- dep: libnetcdf19t64 (>= 3.6.1) [sparc64]
- Interface for scientific data access to large binary data
-
- dep: libnetcdff7 (>= 4.4.1) [ia64, x32 değil]
- Fortran interface for scientific data access to large binary data
-
- dep: libopenmpi3 (>= 4.1.5) [alpha, hppa, ppc64]
- high performance message passing library -- shared library
- dep: libopenmpi3 (>= 4.1.6) [sh4]
-
- dep: libopenmpi3t64 (>= 4.1.6) [alpha, hppa, ia64, ppc64, sh4, x32 değil]
- high performance message passing library -- shared library
-
- dep: libssl3t64 (>= 3.0.0) [sparc64]
- Secure Sockets Layer toolkit - shared libraries
-
- dep: libsz2 (>= 1.1.3) [sparc64]
- Adaptive Entropy Coding library - SZIP
-
- dep: libxc9 (>= 5.1.6) [ia64, x32 değil]
- Library of Exchange-Correlation Functionals
-
- dep: mpi-default-bin [ia64, x32 değil]
- Standard MPI runtime programs (metapackage)
-
- dep: zlib1g (>= 1:1.1.4) [sparc64]
- compression library - runtime
-
- rec: abinit-data
- package for electronic structure calculations (Data files)
-
- sug: abinit-doc
- package for electronic structure calculations (Documentation)
abinit indir
Mimari | Sürüm | Paket Boyutu | Kurulu Boyut | Dosyalar |
---|---|---|---|---|
alpha (resmi olmayan port) | 9.10.4-2 | 31.884,9 kB | 179.456,0 kB | [dosya listesi] |
amd64 | 9.10.4-3+b1 | 34.078,4 kB | 180.583,0 kB | [dosya listesi] |
arm64 | 9.10.4-3+b1 | 27.166,0 kB | 157.689,0 kB | [dosya listesi] |
armel | 9.10.4-3+b1 | 31.377,6 kB | 175.251,0 kB | [dosya listesi] |
armhf | 9.10.4-3+b1 | 27.424,3 kB | 136.787,0 kB | [dosya listesi] |
hppa (resmi olmayan port) | 9.10.4-2 | 32.245,4 kB | 171.242,0 kB | [dosya listesi] |
i386 | 9.10.4-3+b1 | 32.373,5 kB | 189.868,0 kB | [dosya listesi] |
ia64 (resmi olmayan port) | 8.10.3-3 | 25.150,1 kB | 138.842,0 kB | [dosya listesi] |
m68k (resmi olmayan port) | 9.10.4-3+b1 | 25.578,5 kB | 162.919,0 kB | [dosya listesi] |
mips64el | 9.10.4-3+b1 | 27.849,8 kB | 173.613,0 kB | [dosya listesi] |
ppc64 (resmi olmayan port) | 9.10.4-2 | 33.294,5 kB | 183.510,0 kB | [dosya listesi] |
ppc64el | 9.10.4-3+b1 | 34.123,1 kB | 180.347,0 kB | [dosya listesi] |
riscv64 | 9.10.4-3+b1 | 31.099,1 kB | 151.729,0 kB | [dosya listesi] |
s390x | 9.10.4-3+b1 | 36.561,4 kB | 185.148,0 kB | [dosya listesi] |
sh4 (resmi olmayan port) | 9.10.4-3 | 39.934,4 kB | 161.258,0 kB | [dosya listesi] |
sparc64 (resmi olmayan port) | 9.10.4-3+b1 | 29.493,5 kB | 180.773,0 kB | [dosya listesi] |
x32 (resmi olmayan port) | 8.10.3-3 | 17.209,2 kB | 70.685,0 kB | [dosya listesi] |