User contributions for Csheldon

8 July 2024

• 08:1508:15, 8 July 2024 diff hist +2‎ Pulay stress ‎ →‎1. Volume relaxation

5 July 2024

• 13:0013:00, 5 July 2024 diff hist 0‎ Pulay stress ‎No edit summary
• 13:0013:00, 5 July 2024 diff hist +1‎ Pulay stress ‎ →‎Introduction
• 12:5912:59, 5 July 2024 diff hist +250‎ Pulay stress ‎No edit summary
• 12:4912:49, 5 July 2024 diff hist −572‎ Pulay stress ‎No edit summary
• 10:0210:02, 5 July 2024 diff hist +336‎ Pulay stress ‎No edit summary
• 10:0210:02, 5 July 2024 diff hist +314‎ Template:Cite ‎No edit summary
• 09:3409:34, 5 July 2024 diff hist 0‎ Pulay stress ‎No edit summary
• 09:1809:18, 5 July 2024 diff hist −30‎ Pulay stress ‎ →‎Step 4b.
• 09:1509:15, 5 July 2024 diff hist +108‎ Pulay stress ‎ →‎Step 4b.
• 09:1209:12, 5 July 2024 diff hist +148‎ Pulay stress ‎ →‎Step 4b.
• 09:0409:04, 5 July 2024 diff hist +477‎ Pulay stress ‎ →‎Step 4b.
• 07:1707:17, 5 July 2024 diff hist 0‎ File:Kpoint comp.png ‎ Csheldon uploaded a new version of File:Kpoint comp.png
• 07:1507:15, 5 July 2024 diff hist 0‎ File:ENCUT comp.png ‎ Csheldon uploaded a new version of File:ENCUT comp.png

4 July 2024

• 16:2716:27, 4 July 2024 diff hist +121‎ Pulay stress ‎ →‎Step 4b.
• 16:1716:17, 4 July 2024 diff hist −16‎ Pulay stress ‎ →‎Step 4b.
• 16:1616:16, 4 July 2024 diff hist +64‎ Pulay stress ‎ →‎Step 1.
• 16:1016:10, 4 July 2024 diff hist +8‎ Pulay stress ‎No edit summary
• 16:0916:09, 4 July 2024 diff hist +1‎ Pulay stress ‎No edit summary
• 16:0816:08, 4 July 2024 diff hist −88‎ Pulay stress ‎No edit summary
• 16:0016:00, 4 July 2024 diff hist −62‎ Pulay stress ‎ →‎Step 4b.
• 15:5815:58, 4 July 2024 diff hist +9‎ Pulay stress ‎No edit summary
• 15:5215:52, 4 July 2024 diff hist −71‎ Pulay stress ‎No edit summary
• 15:4615:46, 4 July 2024 diff hist −257‎ Pulay stress ‎No edit summary
• 15:4615:46, 4 July 2024 diff hist −825‎ Pulay stress ‎No edit summary
• 15:4415:44, 4 July 2024 diff hist −313‎ Pulay stress ‎No edit summary
• 15:4215:42, 4 July 2024 diff hist 0‎ Pulay stress ‎No edit summary
• 15:4215:42, 4 July 2024 diff hist 0‎ File:Kpoint comp.png ‎ Csheldon uploaded a new version of File:Kpoint comp.png
• 15:3915:39, 4 July 2024 diff hist 0‎ File:Kpoint comp.png ‎ Csheldon uploaded a new version of File:Kpoint comp.png
• 15:3815:38, 4 July 2024 diff hist 0‎ File:ENCUT comp.png ‎ Csheldon uploaded a new version of File:ENCUT comp.png
• 15:0815:08, 4 July 2024 diff hist 0‎ File:Kpoint comp.png ‎ Csheldon uploaded a new version of File:Kpoint comp.png
• 15:0815:08, 4 July 2024 diff hist 0‎ File:ENCUT comp.png ‎ Csheldon uploaded a new version of File:ENCUT comp.png
• 14:2914:29, 4 July 2024 diff hist 0‎ Pulay stress ‎ →‎Possible issues and advice on how to address them
• 14:2914:29, 4 July 2024 diff hist +5‎ Pulay stress ‎ →‎Step 4.
• 14:2214:22, 4 July 2024 diff hist −9‎ Pulay stress ‎ →‎Possible issues and advice on how to address them
• 14:1714:17, 4 July 2024 diff hist +21‎ Pulay stress ‎ →‎2. Equation of state fitting
• 14:1314:13, 4 July 2024 diff hist −5‎ Pulay stress ‎ →‎Step 4b.
• 14:1014:10, 4 July 2024 diff hist +5‎ Pulay stress ‎ →‎Step 4b.
• 14:0914:09, 4 July 2024 diff hist 0‎ Pulay stress ‎ →‎(Optional)
• 14:0814:08, 4 July 2024 diff hist 0‎ Pulay stress ‎ →‎Step 4a.
• 14:0714:07, 4 July 2024 diff hist −2‎ Pulay stress ‎ →‎Step 4a.
• 14:0714:07, 4 July 2024 diff hist +72‎ Pulay stress ‎ →‎Step 4a.
• 14:0614:06, 4 July 2024 diff hist +24‎ Pulay stress ‎ →‎1. Volume relaxation
• 14:0414:04, 4 July 2024 diff hist −21‎ Pulay stress ‎No edit summary
• 13:2313:23, 4 July 2024 diff hist +14‎ Pulay stress ‎ →‎How to correct
• 13:2313:23, 4 July 2024 diff hist +165‎ Pulay stress ‎ →‎How to correct
• 10:0310:03, 4 July 2024 diff hist +1‎ Pulay stress ‎ →‎How to correct
• 09:5809:58, 4 July 2024 diff hist −8‎ Pulay stress ‎ →‎How to correct in VASP
• 09:5409:54, 4 July 2024 diff hist +2‎ Pulay stress ‎No edit summary
• 09:5409:54, 4 July 2024 diff hist +20‎ Pulay stress ‎ →‎Possible issues and advice on how to address it