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Installation

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  1. Download the source files

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    git clone https://github.com/QuantumPackage/qp2.git

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  3. Install the dependencies

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    ./configure # tells you what to install. See in INSTALL.rst

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  5. !! USE AT YOUR OWN RISK, NO SUPPORT WILL BE PROVIDED !!

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    ./configure –install something

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  7. The following libraries are needed for the ocaml package

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    • zlib1g-dev
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    • libncurses5-dev
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    • pkg-config
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    • libgmp3-dev
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    • m4
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  9. Once the SMILING COW APPEAR, load the ENVIRONMENT VARIABLES

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    source quantum_package.rc

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  11. Define your COMPILATION CONFIGURATION FILE

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    ./configure -c ./config/a_file.cfg

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  13. COMPILE with NINJA

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    ninja

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Hartree-Fock calculation

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  • Installation
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  • Hartree-Fock
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  • Full-CI
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