源码包：psi4（1:1.3.2+dfsg-6）
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
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- adep: chemps2
- Executable to call libchemps2-3t64 from the command line
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- adep: cmake
- 跨平台、开源的构建系统
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- adep: debhelper (>> 8)
- 用于 debian/rules 的帮助程序
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- adep: dh-python
- Debian helper tools for packaging Python libraries and applications
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- adep: dvipng
- convert DVI files to PNG graphics
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- adep: gfortran
- GNU Fortran 95 编译器
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- adep: libblas-dev
- Basic Linear Algebra Subroutines 3, static library
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- adep: libchemps2-dev (>= 1.8.5)
- C++ headers, static library, and symlink for libchemps2-3t64
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- adep: libgg-dev (>= 2.0.4)
- Computing gaussians on a grid (development files)
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- adep: libhdf5-dev
- HDF5 - development files - serial version
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- adep: libint-dev (>= 1.2.1-4)
- Evaluate the integrals in modern atomic and molecular theory (devel)
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- adep: liblapack-dev
- Library of linear algebra routines 3 - static version
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- adep: libxc-dev (>= 4.2.3)
- Library of Exchange-Correlation Functionals (development files)
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- adep: python3-deepdiff
- Deep Difference and search of any Python object/data
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- adep: python3-dev
- header files and a static library for Python (default)
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- adep: python3-numpy
- Python library for numerical computations (Python 3)
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- adep: python3-networkx
- tool to create, manipulate and study complex networks (Python3)
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- adep: python3-pybind11
- pybind11 helper module for Python 3
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- adep: python3-pytest
- Simple, powerful testing in Python3
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- adep: python3-setuptools
- Python3 Distutils Enhancements
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- adep: python3-sphinx
- documentation generator for Python projects
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- adep: python3-qcelemental (>= 0.29.0-2)
- Periodic table, physical constants, and molecule parsing for quantum chemistry
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- 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-6.dsc | 2.3 kB | 25a37461c6adbbf799ed814c63a1e27b |
| psi4_1.3.2+dfsg.orig.tar.xz | 18,635.5 kB | 3ef473c556a17510a0f09b81fa3be287 |
| psi4_1.3.2+dfsg-6.debian.tar.xz | 16.3 kB | c1e465acbc8e57d68ead777d66937fad |
- 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