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wien2k:scf計算 [2020/03/20 16:50] koudai [SCF計算の実行] |
wien2k:scf計算 [2020/03/20 19:08] koudai [k点数の変更] |
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< | < | ||
$ rm *.broyd* | $ rm *.broyd* | ||
- | $ run_lapw -ec 0.00001 -cc 0.0001 | + | $ run_lapw -cc 0.0001 -ec 0.00001 |
</ | </ | ||