.. _QuantumESPRESSO: https://www.quantum-espresso.org/resources/users-manual Installation ============ Prerequisite ------------ The prerequisite of SCTK is the same as that of QuantumESPRESSO_. Installation procedure ---------------------- #. Clone thee source code of QuantumESPRESSO_ and SCTK as follows: .. code-block:: bash $ git clone https://gitlab.com/QEF/q-e.git $ cd q-e $ git checkout qe-7.4.1 $ git clone https://github.com/mitsuaki1987/sctk.git -b develop SCTK $ patch -p1 < SCTK/patch.diff To try the developping version, the corresponding original QE hash can be seen at https://github.com/mitsuaki1987/sctk/blob/develop/readme.md This was forked from the original QuantumESPRESSO_. #. Configure the environment with the script ``configure`` as the same as the original QuantumESPRESSO_. .. code-block:: bash $ ./configure #. Make .. code-block:: bash $ make pw ph pp sctk The executable file is ``sctk.x``. Sometimes, we need to ``make`` again because of incomplete compilation of SCTK. .. code-block:: bash $ make sctk