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@ -31,8 +31,11 @@ First create a file named be.</description>
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<pubDate>Wed, 23 Jan 2019 22:33:52 +0100</pubDate>
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<pubDate>Wed, 23 Jan 2019 22:33:52 +0100</pubDate>
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<author>quantum.package@gmail.com</author>
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<author>quantum.package@gmail.com</author>
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<guid>https://quantumpackage.github.io/qp2/page/tutorials/</guid>
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<guid>https://quantumpackage.github.io/qp2/page/tutorials/</guid>
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<description>Installation QP installation.
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<description>Installation #. Download the source files
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Hartree-Fock calculation In this tutorial, you will run a Hartree-Fock calculation on the HCN molecule.</description>
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git clone https://github.com/QuantumPackage/qp2.git #. Install the dependencies
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./configure # tells you what to install. See in INSTALL.rst #. !! USE AT YOUR OWN RISK, NO SUPPORT WILL BE PROVIDED !!
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./configure --install something #. The following libraries are needed for the ocaml package
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zlib1g-dev libncurses5-dev pkg-config libgmp3-dev m4 #. Once the SMILING COW APPEAR, load the ENVIRONMENT VARIABLES</description>
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</item>
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</item>
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</channel>
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</channel>
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@ -156,30 +156,12 @@ First create a file named be.
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</p>
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</p>
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<div class="post-entry">
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<div class="post-entry">
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Installation #. Download the source files
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git clone https://github.com/QuantumPackage/qp2.git #. Install the dependencies
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<hr />
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./configure # tells you what to install. See in INSTALL.rst #. !! USE AT YOUR OWN RISK, NO SUPPORT WILL BE PROVIDED !!
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./configure --install something #. The following libraries are needed for the ocaml package
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<h1 id="installation">Installation</h1>
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zlib1g-dev libncurses5-dev pkg-config libgmp3-dev m4 #. Once the SMILING COW APPEAR, load the ENVIRONMENT VARIABLES
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<a href="https://quantumpackage.github.io/qp2/page/tutorials/" class="post-read-more">[Read More]</a>
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<div style="position: relative; padding-bottom: 56.25%; height: 0; overflow: hidden;">
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<iframe src="//www.youtube.com/embed/Un69atP2-30" style="position: absolute; top: 0; left: 0; width: 100%; height: 100%; border:0;" allowfullscreen title="YouTube Video"></iframe>
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</div>
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<p>QP installation.</p>
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<h1 id="hartree-fock-calculation">Hartree-Fock calculation</h1>
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<div style="position: relative; padding-bottom: 56.25%; height: 0; overflow: hidden;">
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<iframe src="//www.youtube.com/embed/KIl_xq-NRLo" style="position: absolute; top: 0; left: 0; width: 100%; height: 100%; border:0;" allowfullscreen title="YouTube Video"></iframe>
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</div>
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<p>In this tutorial, you will run a Hartree-Fock calculation on the HCN molecule.</p>
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</div>
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</div>
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@ -31,8 +31,11 @@ First create a file named be.</description>
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<pubDate>Wed, 23 Jan 2019 22:33:52 +0100</pubDate>
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<pubDate>Wed, 23 Jan 2019 22:33:52 +0100</pubDate>
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<author>quantum.package@gmail.com</author>
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<author>quantum.package@gmail.com</author>
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<guid>https://quantumpackage.github.io/qp2/page/tutorials/</guid>
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<guid>https://quantumpackage.github.io/qp2/page/tutorials/</guid>
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<description>Installation QP installation.
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<description>Installation #. Download the source files
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Hartree-Fock calculation In this tutorial, you will run a Hartree-Fock calculation on the HCN molecule.</description>
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git clone https://github.com/QuantumPackage/qp2.git #. Install the dependencies
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./configure # tells you what to install. See in INSTALL.rst #. !! USE AT YOUR OWN RISK, NO SUPPORT WILL BE PROVIDED !!
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./configure --install something #. The following libraries are needed for the ocaml package
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zlib1g-dev libncurses5-dev pkg-config libgmp3-dev m4 #. Once the SMILING COW APPEAR, load the ENVIRONMENT VARIABLES</description>
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</item>
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</item>
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</channel>
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</channel>
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@ -8,12 +8,19 @@
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<title>Video Tutorials</title>
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<title>Video Tutorials</title>
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<meta property="og:title" content="Video Tutorials" />
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<meta property="og:title" content="Video Tutorials" />
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<meta name="twitter:title" content="Video Tutorials" />
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<meta name="twitter:title" content="Video Tutorials" />
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<meta name="description" content="Installation QP installation.
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<meta name="description" content="Installation #. Download the source files
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Hartree-Fock calculation In this tutorial, you will run a Hartree-Fock calculation on the HCN molecule.">
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git clone https://github.com/QuantumPackage/qp2.git #. Install the dependencies
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<meta property="og:description" content="Installation QP installation.
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./configure # tells you what to install. See in INSTALL.rst #. !! USE AT YOUR OWN RISK, NO SUPPORT WILL BE PROVIDED !!
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Hartree-Fock calculation In this tutorial, you will run a Hartree-Fock calculation on the HCN molecule.">
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./configure --install something #. The following libraries are needed for the ocaml package
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<meta name="twitter:description" content="Installation QP installation.
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zlib1g-dev libncurses5-dev pkg-config libgmp3-dev m4 #. Once the SMILING COW APPEAR, load the ENVIRONMENT VARIABLES">
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Hartree-Fock calculation In this tutorial, you will run a Hartree-Fock calculation on the HCN molecule.">
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<meta property="og:description" content="Installation #. Download the source files
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git clone https://github.com/QuantumPackage/qp2.git #. Install the dependencies
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./configure # tells you what to install. See in INSTALL.rst #. !! USE AT YOUR OWN RISK, NO SUPPORT WILL BE PROVIDED !!
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./configure --install something #. The following libraries are needed for the ocaml package
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zlib1g-dev libncurses5-dev pkg-config libgmp3-dev m4 #. Once the SMILING COW APPEAR, load the ENVIRONMENT VARIABLES">
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<meta name="twitter:description" content="Installation #. Download the source files
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git clone https://github.com/QuantumPackage/qp2.git #. Install the dependencies
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./configure # tells you what to install. See in INSTALL.rst #. !! USE AT …">
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<meta name="author" content=""/>
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<meta name="author" content=""/>
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<link href='https://quantumpackage.github.io/qp2/favicon' rel='icon' type='image/x-icon'/>
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<link href='https://quantumpackage.github.io/qp2/favicon' rel='icon' type='image/x-icon'/>
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<meta property="og:image" content="https://quantumpackage.github.io/qp2/img/QP2_circle.png" />
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<meta property="og:image" content="https://quantumpackage.github.io/qp2/img/QP2_circle.png" />
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@ -148,7 +155,45 @@ Hartree-Fock calculation In this tutorial, you will run a Hartree-Fock calcula
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</div>
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</div>
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<p>QP installation.</p>
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<p>#. Download the source files</p>
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<pre><code>git clone https://github.com/QuantumPackage/qp2.git
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</code></pre>
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<p>#. Install the dependencies</p>
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<pre><code>./configure # tells you what to install. See in INSTALL.rst
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</code></pre>
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<p>#. !! USE AT YOUR OWN RISK, NO SUPPORT WILL BE PROVIDED !!</p>
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<pre><code>./configure --install something
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</code></pre>
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<p>#. The following libraries are needed for the ocaml package</p>
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<ul>
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<li>zlib1g-dev</li>
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<li>libncurses5-dev</li>
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<li>pkg-config</li>
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<li>libgmp3-dev</li>
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<li>m4</li>
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</ul>
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<p>#. Once the SMILING COW APPEAR, load the ENVIRONMENT VARIABLES</p>
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<pre><code>source quantum_package.rc
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</code></pre>
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<p>#. Define your COMPILATION CONFIGURATION FILE</p>
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<pre><code>./configure -c ./config/a_file.cfg
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</code></pre>
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<p>#. COMPILE with NINJA</p>
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<pre><code>ninja
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</code></pre>
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<h1 id="hartree-fock-calculation">Hartree-Fock calculation</h1>
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<h1 id="hartree-fock-calculation">Hartree-Fock calculation</h1>
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@ -158,8 +203,6 @@ Hartree-Fock calculation In this tutorial, you will run a Hartree-Fock calcula
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</div>
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</div>
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<p>In this tutorial, you will run a Hartree-Fock calculation on the HCN molecule.</p>
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</article>
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</article>
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<ul class="pager blog-pager">
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<ul class="pager blog-pager">
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@ -11,6 +11,38 @@ draft: false
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{{< youtube Un69atP2-30 >}}
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{{< youtube Un69atP2-30 >}}
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#. Download the source files
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git clone https://github.com/QuantumPackage/qp2.git
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#. Install the dependencies
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./configure # tells you what to install. See in INSTALL.rst
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#. !! USE AT YOUR OWN RISK, NO SUPPORT WILL BE PROVIDED !!
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./configure --install something
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#. 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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#. Once the SMILING COW APPEAR, load the ENVIRONMENT VARIABLES
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source quantum_package.rc
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#. Define your COMPILATION CONFIGURATION FILE
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./configure -c ./config/a_file.cfg
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#. COMPILE with NINJA
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ninja
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# Hartree-Fock calculation
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# Hartree-Fock calculation
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