seminar:jacapo_ref
差分
このページの2つのバージョン間の差分を表示します。
| 両方とも前のリビジョン前のリビジョン次のリビジョン | 前のリビジョン | ||
| seminar:jacapo_ref [2019/05/22 14:29] – [Static methods] kimi | seminar:jacapo_ref [2022/08/23 13:34] (現在) – 外部編集 127.0.0.1 | ||
|---|---|---|---|
| 行 42: | 行 42: | ||
| </ | </ | ||
| ===== Class methods ===== | ===== Class methods ===== | ||
| + | * [[ase: | ||
| + | * [[ase: | ||
| + | * [[ase: | ||
| + | * [[ase: | ||
| + | * [[ase: | ||
| + | * [[ase: | ||
| ===== Static methods ===== | ===== Static methods ===== | ||
| <code python> | <code python> | ||
| 行 56: | 行 61: | ||
| </ | </ | ||
| this method is here for legacy purposes. I used to use it alot. | this method is here for legacy purposes. I used to use it alot. | ||
| + | ===== Function ===== | ||
| + | |||
| + | function read in module ase.calculators.jacapo.jacapo: | ||
| + | |||
| + | <code python> | ||
| + | </ | ||
| + | return atoms and calculator from ncfile | ||
| + | ==== example ==== | ||
| + | <code python> | ||
| + | atoms, calc = read(' | ||
| + | </ | ||
| + | |||
| ===== Notes ===== | ===== Notes ===== | ||
seminar/jacapo_ref.1558502997.txt.gz · 最終更新: (外部編集)