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#author("2025-06-15T11:45:19+09:00","default:StatE","StatE")
#author("2025-06-15T11:45:38+09:00","default:StatE","StatE")
* Installation [#d6729d89]
Here how to compile Quantum-ESPRESSO 6.1.0 on smith@Morikawa Group, Osaka University.

First of all, make sure that the modules are loaded properly.
In this tutorial, the following modules are used:
 intel/2020.2.254
 intelmpi/2020.2.254
 python/3.8

To load the above modules, add the following in ${HOME}/.bashrc:
 module load intel/2020.2.254
 module load intelmpi/2020.2.254
 module load python/3.8
Make sure that old settings for intel compiler are deleted/commented out.

Let us first make directories for source codes, pseudopotentials, and calculations for Quantum-ESPRESSO in the home directory, for e.g.

 $ mkdir -p QE/src
 $ mkdir -p QE/pseudo
 $ mkdir -p QE/out

** Obtaining the code [#p1d66cbf]
*** QE [#y59933f7]
In the ${HOME}/QE/src directory, type
 $ git clone -b 'qe-6.1.0' --depth 1 https://gitlab.com/QEF/q-e.git qe-6.1.0
or
 $ wget https://gitlab.com/QEF/q-e/-/archive/qe-6.1.0/q-e-qe-6.1.0.tar.gz 
In the latter case, the resulting directory name will be q-q-qe-6.1.0.
*** ACFDT [#s130fa6a]
In the qe-6.1.0 or q-e-qe-6.1.0, type
 $ git clone https://gitlab.com/QEF/qe-acfdt.git ACFDT
Then revert it to the commit, which is aligned to qe-6.1.0 as
 $ git checkout dba1356ff3922a49b8c0ba607c9056b0fb9433b4
Go to the ACFDT/qe_file directory and type
 $install-qehacks.sh
to replace some files necessary for the ACFDT code.
** Configure and build [#w584f029]
*** QE [#ld47b655]
In qe-6.1.0, execute the following
 $ ./configure MPIF90=mpiifort --enable-openmp --with-scalapack=intel
Then type
 $ make acfdt