User contributions for Kresse

2 June 2023

• 08:5008:50, 2 June 2023 diff hist +66‎ NBLOCK ‎No edit summary Tag: Visual edit

9 May 2023

• 13:3513:35, 9 May 2023 diff hist −19‎ m ML RCUT2 ‎ Type corrected. current Tag: Visual edit: Switched
• 12:0812:08, 9 May 2023 diff hist +20‎ m ML RCUT2 ‎No edit summary Tag: Visual edit: Switched
• 12:0612:06, 9 May 2023 diff hist +47‎ m ML RCUT2 ‎No edit summary Tag: Visual edit: Switched
• 12:0412:04, 9 May 2023 diff hist +372‎ ML RCUT2 ‎ Hints on how to vary ML_RCUT1 Tag: Visual edit

28 April 2023

• 14:0614:06, 28 April 2023 diff hist +199‎ LREAL ‎No edit summary Tag: Visual edit

12 April 2023

• 07:3107:31, 12 April 2023 diff hist +104‎ NATURALO ‎No edit summary
• 07:2607:26, 12 April 2023 diff hist +82‎ m NATURALO ‎ HF singles documented Tag: Visual edit

11 April 2023

• 13:5213:52, 11 April 2023 diff hist +1‎ m PMASS ‎No edit summary Tag: Visual edit

3 April 2023

• 17:0817:08, 3 April 2023 diff hist −29‎ m ML MODE ‎No edit summary Tag: Visual edit

2 April 2023

• 08:5508:55, 2 April 2023 diff hist +9‎ m ML CTIFOR ‎No edit summary Tag: Visual edit
• 08:5508:55, 2 April 2023 diff hist +363‎ ML CTIFOR ‎ Added typical values that ML_CTIFOR will attain. Tag: Visual edit

31 March 2023

• 15:4115:41, 31 March 2023 diff hist +1,212‎ Best practices for machine-learned force fields ‎ Improvements in many places, mostly grammer, but also added hints Tag: Visual edit

30 March 2023

• 17:5717:57, 30 March 2023 diff hist 0‎ m LFOCKACE ‎No edit summary Tag: Visual edit
• 17:5317:53, 30 March 2023 diff hist −5‎ LFOCKACE ‎No edit summary Tag: Visual edit
• 17:5217:52, 30 March 2023 diff hist +70‎ m LFOCKACE ‎No edit summary Tag: Visual edit
• 17:5117:51, 30 March 2023 diff hist +222‎ m LFOCKACE ‎ Good scientific practice added. Tag: Visual edit
• 11:3211:32, 30 March 2023 diff hist +28‎ ML MODE ‎No edit summary Tag: Visual edit

29 March 2023

• 12:1712:17, 29 March 2023 diff hist +48‎ m NMAXFOCKAE and LMAXFOCKAE ‎No edit summary current Tag: Visual edit
• 12:1412:14, 29 March 2023 diff hist +303‎ m NMAXFOCKAE and LMAXFOCKAE ‎No edit summary Tag: Visual edit