wien2k:インストール_19.1
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wien2k:インストール_19.1 [2020/03/17 09:48] koudai [ユーザーごとの設定] |
wien2k:インストール_19.1 [2020/07/01 20:32] koudai [コンパイル（Ubuntu18.04 + WIEN2k_19.1 + Intel Parallel Studio XE 2019）] |
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| [[http:// | [[http:// | ||
| - | * WIEN2k_19.1.tarを入手し、インストールするフォルダに入れる | + | |
| + | $ mkdir WIEN2k_19.1 | ||
| + | </ | ||
| + | | ||
| * インストールするフォルダに入って、HPの手順通りに実行するとコードが展開される< | * インストールするフォルダに入って、HPの手順通りに実行するとコードが展開される< | ||
| $ tar -xvf WIEN2k_19.1.tar | $ tar -xvf WIEN2k_19.1.tar | ||
| Line 42: | Line 45: | ||
| - [Your compiler:] cc (Intelコンパイラは非推奨) | - [Your compiler:] cc (Intelコンパイラは非推奨) | ||
| - Specify LIBXC settings | - Specify LIBXC settings | ||
| - | - [Would you like to use LIBXC (that you have installed)? (y, | + | - [Would you like to use LIBXC (that you have installed)? (y,N):] n |
| - | - [Do you want to automatically search for LIBXC installations? | + | |
| - | - [Please specify a comma separated list of directories to search! (If no list is entered, /usr/local and /opt will be searched as default):] /opt/ | + | |
| - | - [Is this the correct directory? (Y,n):] y | + | |
| - Specify FFTW settings | - Specify FFTW settings | ||
| - [Do you want to use FFTW (recommended, | - [Do you want to use FFTW (recommended, | ||
| Line 56: | Line 56: | ||
| - [Please specify the name of your FFTW library or accept present choice (enter):] Enter | - [Please specify the name of your FFTW library or accept present choice (enter):] Enter | ||
| - [Is this correct? (Y,n):] y | - [Is this correct? (Y,n):] y | ||
| + | - [Selection: | ||
| - Configure Parallel Execution | - Configure Parallel Execution | ||
| - [Shared Memory Architecture? | - [Shared Memory Architecture? | ||
| Line 99: | Line 100: | ||
| - Set PDFREADER to evince (Y/n): y | - Set PDFREADER to evince (Y/n): y | ||
| - How many cores do you want to use by default (4): (パソコンのコア数を入力。コマンドnprocで調べられる) | - How many cores do you want to use by default (4): (パソコンのコア数を入力。コマンドnprocで調べられる) | ||
| - | - Set OMP_NUM_THREADS to | + | - Set OMP_NUM_THREADS to |
| - Do you want to continue (Y/n)?: y | - Do you want to continue (Y/n)?: y | ||
| - Edit .rhosts file now? (y/N): n | - Edit .rhosts file now? (y/N): n | ||
wien2k/インストール_19.1.txt · Last modified: 2021/06/27 22:04 (external edit)
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