第一原理分子動力学プログラム STATE Senri Wiki
開始行:
* Preliminaries [#i4fa0667]
In this tutorial, you are supposed to use the precompiled...
~ikutaro/QE/src/qe-6.6
and the pseudopotentials placed in
~ikutaro/QE/pseudo/
If you want to use your own version of the code, follow t...
Input files and job scripts are archived and placed in
~ikutaro/QE/tutorial
For the H2 example, copy h2.tgz by typing
$ cp ~ikutaro/QE/tutorial/h2.tgz .
in your tutorial direcotry
and expand in your directory as
$ tar zxf h2.tgz
and remove the tar file
$ rm -f h2.tgz
終了行:
* Preliminaries [#i4fa0667]
In this tutorial, you are supposed to use the precompiled...
~ikutaro/QE/src/qe-6.6
and the pseudopotentials placed in
~ikutaro/QE/pseudo/
If you want to use your own version of the code, follow t...
Input files and job scripts are archived and placed in
~ikutaro/QE/tutorial
For the H2 example, copy h2.tgz by typing
$ cp ~ikutaro/QE/tutorial/h2.tgz .
in your tutorial direcotry
and expand in your directory as
$ tar zxf h2.tgz
and remove the tar file
$ rm -f h2.tgz
ページ名: