packages
[ Quellcode: psi4 ]
Paket: psi4 (1:1.3.2+dfsg-2.1) [universe]
Links für psi4
Ubuntu-Ressourcen:
Quellcode-Paket psi4 herunterladen:
Betreuer:
Please consider filing a bug or asking a question via Launchpad before contacting the maintainer directly.
Original Maintainers (usually from Debian):
- Debichem Team (E-Mail-Archiv)
- Michael Banck
- Graham Inggs
It should generally not be necessary for users to contact the original maintainer.
Externe Ressourcen:
- Homepage [www.psicode.org]
Ähnliche Pakete:
Quantum Chemical Program Suite
Andere Pakete mit Bezug zu psi4
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- dep: libblas3
- Basic Linear Algebra Reference implementations, shared library
- oder libblas.so.3
- virtuelles Paket, bereitgestellt durch libatlas3-base, libblas3, libblis3-openmp, libblis3-pthread, libblis3-serial, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial
-
- dep: libc6 (>= 2.34)
- GNU C Library: Shared libraries
-
- dep: libchemps2-3 (>= 1.8.7)
- Spin-adapted DMRG for ab initio quantum chemistry
-
- dep: libgcc-s1 (>= 3.3.1) [nicht armhf, riscv64]
- GCC support library
- dep: libgcc-s1 (>= 3.4) [riscv64]
- dep: libgcc-s1 (>= 3.5) [armhf]
-
- dep: libgg2 (>= 2.0.7)
- Computing gaussians on a grid
-
- dep: libgomp1 (>= 6)
- GCC OpenMP (GOMP) support library
-
- dep: libint1
- Evaluate the integrals in modern atomic and molecular theory
-
- dep: liblapack3
- Library of linear algebra routines 3 - shared version
- oder liblapack.so.3
- virtuelles Paket, bereitgestellt durch libatlas3-base, liblapack3, libopenblas0-openmp, libopenblas0-pthread, libopenblas0-serial
-
- dep: libstdc++6 (>= 12)
- GNU Standard C++ Library v3
-
- dep: libxc9 (>= 5.0.0)
- Library of Exchange-Correlation Functionals
-
- dep: psi4-data (= 1:1.3.2+dfsg-2.1)
- Quantum Chemical Program Suite (data files)
-
- dep: python3
- interactive high-level object-oriented language (default python3 version)
- dep: python3 (<< 3.11)
- dep: python3 (>= 3.10~)
-
- dep: python3-deepdiff
- Deep Difference and search of any Python object/data
-
- dep: python3-networkx
- tool to create, manipulate and study complex networks (Python3)
-
- dep: python3-numpy
- Fast array facility to the Python 3 language
-
- dep: python3-pybind11
- pybind11 helper module for Python 3
-
- dep: python3-qcelemental
- Periodic table, physical constants, and molecule parsing for quantum chemistry
psi4 herunterladen
| Architektur | Paketgröße | Größe (installiert) | Dateien |
|---|---|---|---|
| amd64 | 6.358,5 kB | 22.452,0 kB | [Liste der Dateien] |
| arm64 | 5.588,7 kB | 19.160,0 kB | [Liste der Dateien] |
| armhf | 6.125,3 kB | 16.533,0 kB | [Liste der Dateien] |
| ppc64el | 6.023,8 kB | 23.539,0 kB | [Liste der Dateien] |
| riscv64 | 6.328,5 kB | 19.805,0 kB | [Liste der Dateien] |
| s390x | 5.685,4 kB | 22.215,0 kB | [Liste der Dateien] |