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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)] |
wien2k:インストール_19.1 [2021/04/03 02:33] koudai [コンパイル(Ubuntu18.04 + WIEN2k_19.1 + Intel Parallel Studio XE 2019)] |
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- | ====== | + | ====== |
以下のソフトを事前にインストールしてください。 | 以下のソフトを事前にインストールしてください。 | ||
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* tcsh | * tcsh | ||
* XCrySDen | * XCrySDen | ||
- | * FFTW3(MPI版) | + | * MPIでコンパイルしたFFTW3 |
- | * Libxc | + | |
* C/ | * C/ | ||
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- [Please specify whether you want to use FFTW3 (default) or FFTW2 (FFTW3 / FFTW2):] fftw3 | - [Please specify whether you want to use FFTW3 (default) or FFTW2 (FFTW3 / FFTW2):] fftw3 | ||
- [Do you want to use a FFTW version from the list above? (Y,n):] y | - [Do you want to use a FFTW version from the list above? (Y,n):] y | ||
- | - [Please enter the line number of the chosen version or enter 0 to manually specify your choice!:] Enter | + | - [Please enter the line number of the chosen version or enter 0 to manually specify your choice!:] 0 |
+ | - [Please specify the path of your FFTW installation (like / | ||
- [Please specify the target achitecture of your FFTW library (e.g. lib64) or accept present choice (enter):] **lib** | - [Please specify the target achitecture of your FFTW library (e.g. lib64) or accept present choice (enter):] **lib** | ||
- [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 |