第一原理分子動力学プログラム STATE Senri Wiki
開始行:
* Miscellaneous information on the STATE code [#e9303bb4]
** Examples of analyses [#wacce1cc]
- COOP analysis
- Vibrational mode analysis
-- [[CO/Cu(110) interface>STATE_new_tutorial/Cu110-CO_en]]
- Charge density difference analysis
** How-tos on the utility programs [#h6cb4fa8]
- chkinpf
- geom2nfinp
- slabgen
- shiftcps / rot cps
- [[vdos-simple>STATE_new_tutorial_en/vdos-simple]]
** Examples of job scripts [#aae65b68]
- smith
- ohtaka
- kugui
- SQUID
- Wisteria (Odyssey)
終了行:
* Miscellaneous information on the STATE code [#e9303bb4]
** Examples of analyses [#wacce1cc]
- COOP analysis
- Vibrational mode analysis
-- [[CO/Cu(110) interface>STATE_new_tutorial/Cu110-CO_en]]
- Charge density difference analysis
** How-tos on the utility programs [#h6cb4fa8]
- chkinpf
- geom2nfinp
- slabgen
- shiftcps / rot cps
- [[vdos-simple>STATE_new_tutorial_en/vdos-simple]]
** Examples of job scripts [#aae65b68]
- smith
- ohtaka
- kugui
- SQUID
- Wisteria (Odyssey)
ページ名: