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:
$ 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
configureas the same as the original QuantumESPRESSO.$ ./configureMake
$ make pw ph pp sctk
The executable file is
sctk.x. Sometimes, we need tomakeagain because of incomplete compilation of SCTK.$ make sctk