[ Källkod: gpaw ]
Paket: gpaw (22.1.0-1build1)
Länkar för gpaw
Trisquelresurser:
Hämta källkodspaketet gpaw:
Ansvarig:
Original Maintainers:
- Debichem Team (E-postarkiv)
- Marcin Dulak
- Graham Inggs
Externa resurser:
- Hemsida [wiki.fysik.dtu.dk]
Liknande paket:
DFT and beyond within the projector-augmented wave method
A density-functional theory (DFT) Python code based on the projector-augmented wave (PAW) method and the atomic simulation environment (ASE). It uses real-space uniform grids and multigrid methods, atom-centered basis-functions or plane-waves.
Andra paket besläktade med gpaw
|
|
|
-
- dep: gpaw-data
- gpaw datasets/setups
-
- dep: libc6 (>= 2.14) [amd64]
- GNU C Library: Shared libraries
också ett virtuellt paket som tillhandahålls av libc6-udeb
- dep: libc6 (>= 2.17) [arm64, ppc64el]
- dep: libc6 (>= 2.4) [armhf]
-
- dep: libelpa17 (>= 2021.11.001)
- Eigenvalue SoLvers for Petaflop-Applications
-
- dep: libfftw3-double3 (>= 3.3.5)
- Library for computing Fast Fourier Transforms - Double precision
-
- dep: libopenmpi3 (>= 4.1.2)
- high performance message passing library -- shared library
-
- dep: libscalapack-openmpi2.1 (>= 2.1.0)
- Scalable Linear Algebra Package - Shared libs for OpenMPI
-
- dep: libxc9 (>= 5.0.0)
- Library of Exchange-Correlation Functionals
-
- dep: openmpi-bin
- high performance message passing library -- binaries
-
- dep: python3
- interactive high-level object-oriented language (default python3 version)
- dep: python3 (<< 3.11)
- dep: python3 (>= 3.10~)
-
- dep: python3-ase (>= 3.22.1)
- Atomic Simulation Environment (Python 3)
-
- dep: python3-numpy (>= 1:1.20.0)
- Fast array facility to the Python 3 language
-
- dep: python3-numpy-abi9
- virtuellt paket som tillhandahålls av python3-numpy
-
- dep: python3-scipy
- scientific tools for Python 3
Hämta gpaw
| Arkitektur | Paketstorlek | Installerad storlek | Filer |
|---|---|---|---|
| amd64 | 1.253,3 kbyte | 6612 kbyte | [filförteckning] |
| arm64 | 1.252,6 kbyte | 6547 kbyte | [filförteckning] |
| armhf | 1.227,9 kbyte | 6466 kbyte | [filförteckning] |
| ppc64el | 1.284,2 kbyte | 6647 kbyte | [filförteckning] |