源码包：psi4（1:1.3.2+dfsg-2）
本源码包构建了以下这些二进制包：
其他与 psi4 有关的软件包
|
|
-
- adep: chemps2
- Executable to call libchemps2-3 from the command line
-
- adep: cmake
- cross-platform, open-source make system
-
- adep: debhelper (>> 8)
- 用于 debian/rules 的帮助程序
-
- adep: dh-python
- 用于打包 Python 库和应用程序的 Debian 帮助工具
-
- adep: dvipng
- convert DVI files to PNG graphics
-
- adep: gfortran
- GNU Fortran 95 编译器
-
- adep: libblas-dev
- Basic Linear Algebra Subroutines 3, static library
-
- adep: libchemps2-dev (>= 1.8.5)
- C++ headers, static library, and symlink for libchemps2-3
-
- adep: libgg-dev (>= 2.0.4)
- Computing gaussians on a grid (development files)
-
- adep: libhdf5-dev
- HDF5 - development files - serial version
-
- adep: libint-dev (>= 1.2.1-4)
- Evaluate the integrals in modern atomic and molecular theory (devel)
-
- adep: liblapack-dev
- Library of linear algebra routines 3 - static version
-
- adep: libxc-dev (>= 4.2.3)
- Library of Exchange-Correlation Functionals (development files)
-
- adep: python3-qcelemental
- Periodic table, physical constants, and molecule parsing for quantum chemistry
-
- adep: python3-deepdiff
- Deep Difference and search of any Python object/data
-
- adep: python3-dev
- header files and a static library for Python (default)
-
- adep: python3-numpy
- Fast array facility to the Python 3 language
-
- adep: python3-networkx
- tool to create, manipulate and study complex networks (Python3)
-
- adep: python3-pybind11
- pybind11 helper module for Python 3
-
- adep: python3-pytest
- Simple, powerful testing in Python3
-
- adep: python3-sphinx
- documentation generator for Python projects
-
- adep: texlive-latex-extra
- TeX Live: LaTeX additional packages
Download psi4
| 文件 | 大小（单位：kB） | MD5 校验码 |
|---|---|---|
| psi4_1.3.2+dfsg-2.dsc | 2.3 kB | 4ddaca947ce924722d9d41cd4c544b90 |
| psi4_1.3.2+dfsg.orig.tar.xz | 18,635.5 kB | 3ef473c556a17510a0f09b81fa3be287 |
| psi4_1.3.2+dfsg-2.debian.tar.xz | 14.2 kB | bac7cae2aa0b9e95647d21cee7ba6b18 |
- Debian 软件包源码仓库（VCS：Git）
- https://salsa.debian.org/debichem-team/psi4.git
- Debian 软件包源码仓库（可在线浏览）
- https://salsa.debian.org/debichem-team/psi4