User contributions for Csheldon

13:5713:57, 9 July 2024 diff hist +6‎ Pulay stress ‎ →‎Introduction
13:5613:56, 9 July 2024 diff hist +26‎ Pulay stress ‎No edit summary
12:4912:49, 9 July 2024 diff hist 0‎ Pulay stress ‎ →‎Step 4.
12:4812:48, 9 July 2024 diff hist 0‎ Pulay stress ‎No edit summary
12:3812:38, 9 July 2024 diff hist −1‎ Pulay stress ‎ →‎Introduction
12:3812:38, 9 July 2024 diff hist 0‎ Pulay stress ‎No edit summary

08:5108:51, 8 July 2024 diff hist 0‎ Pulay stress ‎ →‎Possible issues and advice on how to address them
08:4408:44, 8 July 2024 diff hist 0‎ File:Kpoint comp.png ‎ Csheldon uploaded a new version of File:Kpoint comp.png
08:4408:44, 8 July 2024 diff hist 0‎ File:ENCUT comp.png ‎ Csheldon uploaded a new version of File:ENCUT comp.png
08:4408:44, 8 July 2024 diff hist +12‎ Pulay stress ‎ →‎How to correct
08:1608:16, 8 July 2024 diff hist +2‎ Pulay stress ‎ →‎1. Volume relaxation
08:1608:16, 8 July 2024 diff hist 0‎ Pulay stress ‎ →‎Step 4b.
08:1608:16, 8 July 2024 diff hist 0‎ Pulay stress ‎ →‎1. Volume relaxation
08:1508:15, 8 July 2024 diff hist −1‎ Pulay stress ‎ →‎1. Volume relaxation
08:1508:15, 8 July 2024 diff hist +2‎ Pulay stress ‎ →‎1. Volume relaxation

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

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

9 July 2024

8 July 2024

5 July 2024

4 July 2024