mirror of
https://github.com/pfloos/quack
synced 2024-12-23 04:43:42 +01:00
16 lines
409 B
Markdown
16 lines
409 B
Markdown
The QuAcK software can be downloaded on GitHub as a Git repository
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```
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git clone https://github.com/pfloos/QuAcK.git
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```
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Then, one must define the variable `QUACK_ROOT`. For example,
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```
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export QUACK_ROOT=$HOME/Work/QuAcK
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```
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You must also install [PySCF](https://pyscf.org) (for example using `pip`)
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```
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pip install pyscf
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```
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PySCF is used for the computation of one- and two-electron integrals (mainly).
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