User contributions for Karsai

18 December 2024

• 14:4214:42, 18 December 2024 diff hist +117‎ ML ICRITERIA ‎No edit summary current
• 14:4014:40, 18 December 2024 diff hist +214‎ ML CTIFOR ‎No edit summary current
• 14:3914:39, 18 December 2024 diff hist +1,133‎ N ML CALGO ‎ Created page with "{{DISPLAYTITLE:ML_CALGO}} {{TAGDEF|ML_CALGO|[integer]|0}} Description: Chooses error estimation type for on-the-fly training or reselection of local referenc configurations. ---- This tag chooes which algorithm is employed for the error estimation in {{TAG|ML_MODE}}=''TRAIN'' or ''SELECT''. The following two choices are available: *{{TAG|ML_CALGO}}=0: Bayesian error estimation. Constant or variable threshold. Default. *{{TAG|ML_CALGO}}=1: Spilling factor. Constant thr..." current
• 14:3814:38, 18 December 2024 diff hist +1,498‎ ML IERR ‎No edit summary current
• 09:5909:59, 18 December 2024 diff hist −2‎ Best practices for machine-learned force fields ‎No edit summary current
• 09:5809:58, 18 December 2024 diff hist +1‎ Best practices for machine-learned force fields ‎ →‎Descriptor reduction in production runs
• 09:5709:57, 18 December 2024 diff hist −130‎ Best practices for machine-learned force fields ‎ →‎Descriptor reduction in production runs
• 09:4509:45, 18 December 2024 diff hist +4‎ Best practices for machine-learned force fields ‎ →‎Descriptor reduction in production runs
• 09:4509:45, 18 December 2024 diff hist +114‎ Best practices for machine-learned force fields ‎ →‎Descriptor reduction in production runs
• 09:4109:41, 18 December 2024 diff hist −20‎ Best practices for machine-learned force fields ‎No edit summary
• 09:3809:38, 18 December 2024 diff hist +2,461‎ Best practices for machine-learned force fields ‎No edit summary

17 October 2024

• 14:1014:10, 17 October 2024 diff hist +173‎ HESSEMAT ‎No edit summary current
• 14:1014:10, 17 October 2024 diff hist +174‎ TILAMBDA ‎No edit summary current
• 14:0814:08, 17 October 2024 diff hist +8‎ TILAMBDA ‎No edit summary
• 14:0714:07, 17 October 2024 diff hist −1‎ HESSEMAT ‎ →‎Related tags and articles
• 14:0714:07, 17 October 2024 diff hist +67‎ HESSEMAT ‎No edit summary
• 14:0614:06, 17 October 2024 diff hist −509‎ TI LAMBDA ‎ Blanked the page current Tag: Blanking
• 14:0614:06, 17 October 2024 diff hist +509‎ N TILAMBDA ‎ Created page with "{{DISPLAYTITLE:TILAMBDA}} {{TAGDEF|TILAMBDA|real | 0.0}} Description: {{TAG|TILAMBDA}} defines the coupling parameter <math>\lambda</math> used in Thermodynamic integration with harmonic reference. The value of <math>\lambda</math> must be from the inverval <math>\langle 0, 1 \rangle</math>. == Related tags and articles == {{TAG|HESSEMAT}}, {{TAG|REPORT}} Category:INCARCategory:Adva..."
• 14:0614:06, 17 October 2024 diff hist −1‎ Thermodynamic integration calculations ‎ →‎Alternative way of thermodynamic integration for harmonic solid current
• 14:0514:05, 17 October 2024 diff hist −3‎ TI LAMBDA ‎No edit summary
• 14:0414:04, 17 October 2024 diff hist +1‎ TI LAMBDA ‎No edit summary Tag: Manual revert
• 14:0414:04, 17 October 2024 diff hist −1‎ TI LAMBDA ‎No edit summary Tags: Manual revert Reverted
• 14:0414:04, 17 October 2024 diff hist +1‎ TI LAMBDA ‎No edit summary Tag: Reverted
• 14:0414:04, 17 October 2024 diff hist +16‎ TI LAMBDA ‎No edit summary
• 14:0314:03, 17 October 2024 diff hist +66‎ TI LAMBDA ‎No edit summary
• 14:0314:03, 17 October 2024 diff hist +16‎ HESSEMAT ‎No edit summary
• 14:0214:02, 17 October 2024 diff hist +1‎ HESSEMAT ‎No edit summary
• 14:0214:02, 17 October 2024 diff hist +68‎ HESSEMAT ‎No edit summary
• 14:0114:01, 17 October 2024 diff hist +7,116‎ Thermodynamic integration ‎No edit summary current Tag: Manual revert
• 14:0014:00, 17 October 2024 diff hist −50‎ TI LAMBDA ‎No edit summary
• 13:5913:59, 17 October 2024 diff hist +3‎ TI LAMBDA ‎No edit summary
• 13:5913:59, 17 October 2024 diff hist −30‎ TI LAMBDA ‎No edit summary
• 13:5713:57, 17 October 2024 diff hist −7,116‎ Thermodynamic integration ‎ Blanked the page Tags: Blanking Reverted
• 13:5613:56, 17 October 2024 diff hist +960‎ Thermodynamic integration calculations ‎No edit summary
• 13:5513:55, 17 October 2024 diff hist +5,794‎ Thermodynamic integration ‎No edit summary
• 13:5313:53, 17 October 2024 diff hist −16‎ The VASP Manual ‎ →‎Featured topics

16 October 2024

• 14:1614:16, 16 October 2024 diff hist −51‎ SPRING V0 ‎No edit summary current
• 14:1614:16, 16 October 2024 diff hist −51‎ SPRING R0 ‎No edit summary current
• 14:1614:16, 16 October 2024 diff hist −51‎ SPRING K ‎No edit summary current
• 14:1514:15, 16 October 2024 diff hist −31‎ SHAKETOL ‎No edit summary current
• 14:1514:15, 16 October 2024 diff hist −31‎ SHAKEMAXITER ‎No edit summary current
• 14:1414:14, 16 October 2024 diff hist −32‎ REPORT ‎No edit summary current
• 14:1414:14, 16 October 2024 diff hist −69‎ PENALTYPOT ‎No edit summary current
• 14:1314:13, 16 October 2024 diff hist −31‎ LBLUEOUT ‎ →‎Related tags and articles current
• 14:1314:13, 16 October 2024 diff hist −31‎ INCREM ‎No edit summary current
• 14:1314:13, 16 October 2024 diff hist −38‎ ICONST ‎ →‎Related tags and articles current
• 14:1214:12, 16 October 2024 diff hist −51‎ FBIAS R0 ‎ →‎Related tags and articles current
• 14:1214:12, 16 October 2024 diff hist −51‎ FBIAS D ‎No edit summary current
• 14:1114:11, 16 October 2024 diff hist −51‎ FBIAS A ‎No edit summary current
• 14:1014:10, 16 October 2024 diff hist +226‎ Thermodynamic integration calculations ‎No edit summary