User contributions for Wolloch
28 February 2025
- 10:2410:24, 28 February 2025 diff hist −53 Setting up an electronic minimization →Step-by-step instructions
- 08:5308:53, 28 February 2025 diff hist −84 OSZICAR No edit summary
27 February 2025
- 16:3816:38, 27 February 2025 diff hist +3,048 Setting up an electronic minimization No edit summary
- 16:1916:19, 27 February 2025 diff hist +186 Setting up an electronic minimization →Example
- 16:1016:10, 27 February 2025 diff hist +158 Setting up an electronic minimization →Creating the KPOINTS file
- 16:0716:07, 27 February 2025 diff hist +27 Setting up an electronic minimization →Step-by-step instructions
- 16:0616:06, 27 February 2025 diff hist +31 Setting up an electronic minimization →Creating the KPOINTS file
- 15:5815:58, 27 February 2025 diff hist +930 Setting up an electronic minimization No edit summary
- 15:3315:33, 27 February 2025 diff hist +1 Setting up an electronic minimization →Step-by-step instructions
- 15:3315:33, 27 February 2025 diff hist +35 Setting up an electronic minimization →Step-by-step instructions
- 15:3115:31, 27 February 2025 diff hist +260 Setting up an electronic minimization →Creating the KPOINTS file
- 15:2215:22, 27 February 2025 diff hist 0 Setting up an electronic minimization No edit summary
- 15:2215:22, 27 February 2025 diff hist +134 Setting up an electronic minimization →Creating the KPOINTS file
- 15:1715:17, 27 February 2025 diff hist +464 Setting up an electronic minimization →Creating the POTCAR file
- 14:4814:48, 27 February 2025 diff hist +151 Setting up an electronic minimization →Example
- 14:4514:45, 27 February 2025 diff hist +1,976 Setting up an electronic minimization →Example
- 14:1914:19, 27 February 2025 diff hist +71 Setting up an electronic minimization No edit summary
- 14:0614:06, 27 February 2025 diff hist +636 Setting up an electronic minimization No edit summary
26 February 2025
- 16:3516:35, 26 February 2025 diff hist +15 Setting up an electronic minimization No edit summary
- 16:3516:35, 26 February 2025 diff hist 0 Template:Cite No edit summary
- 16:3216:32, 26 February 2025 diff hist +118 Template:Cite No edit summary
- 16:1516:15, 26 February 2025 diff hist +2,153 Setting up an electronic minimization No edit summary
- 14:4414:44, 26 February 2025 diff hist +249 Setting up an electronic minimization No edit summary
- 12:1312:13, 26 February 2025 diff hist +390 Setting up an electronic minimization No edit summary
- 11:5711:57, 26 February 2025 diff hist +25 Setting up an electronic minimization →Step-by-step instructions
- 11:5211:52, 26 February 2025 diff hist +87 Setting up an electronic minimization →References
25 February 2025
- 15:2215:22, 25 February 2025 diff hist +998 N Setting up an electronic minimization Created page with "Setting up an electronic minimization calculation using density-functional theory requires a few steps. The input files must be created or copied into the execution folder. This includes making a few choices for the '''k''' point sampling and electronic smearing, minimization algorithm, and [[:Category:Exchange-correlation functionals|exchange-correlation functionals]..."
17 January 2025
- 14:2614:26, 17 January 2025 diff hist −37 LPARDH5 No edit summary current
- 14:2514:25, 17 January 2025 diff hist −37 EFOR No edit summary current
20 December 2024
- 11:0411:04, 20 December 2024 diff hist +7 Band-decomposed charge densities No edit summary current
- 11:0311:03, 20 December 2024 diff hist +60 Band-decomposed charge densities Redirected page to Partial charge densities and STM simulations Tag: New redirect
- 10:5910:59, 20 December 2024 diff hist +58 N Construction:Partial charge densities and STM simulations Wolloch moved page Construction:Partial charge densities and STM simulations to Partial charge densities and STM simulations current Tag: New redirect
- 10:5910:59, 20 December 2024 diff hist 0 m Partial charge densities and STM simulations Wolloch moved page Construction:Partial charge densities and STM simulations to Partial charge densities and STM simulations current
- 10:5910:59, 20 December 2024 diff hist −3 Partial charge densities and STM simulations →Step-by-step instructions for simulating an STM picture
- 10:5910:59, 20 December 2024 diff hist −13 Partial charge densities and STM simulations →Step-by-step instructions for simulating an STM picture
- 10:5710:57, 20 December 2024 diff hist 0 Partial charge densities and STM simulations →Step-by-step instructions for simulating an STM picture
19 December 2024
- 14:4514:45, 19 December 2024 diff hist +49 Partial charge densities and STM simulations →Step-by-step instructions for simulating an STM picture
- 14:4114:41, 19 December 2024 diff hist −10 Partial charge densities and STM simulations →Step-by-step instructions for simulating an STM picture
- 14:3914:39, 19 December 2024 diff hist −17 Partial charge densities and STM simulations →Step-by-step instructions for simulating an STM picture
- 14:3814:38, 19 December 2024 diff hist −7 Partial charge densities and STM simulations →Output files
- 14:3714:37, 19 December 2024 diff hist −1 Partial charge densities and STM simulations →Input tags for selecting and writing the partial charges
18 December 2024
- 14:0214:02, 18 December 2024 diff hist +377 LPARDH5 No edit summary
- 13:5213:52, 18 December 2024 diff hist +297 PARCHG No edit summary
- 13:5113:51, 18 December 2024 diff hist +23 LSEPB No edit summary current
- 13:5113:51, 18 December 2024 diff hist +16 LSEPK No edit summary current
- 13:4913:49, 18 December 2024 diff hist −7 LSEPB →Related tags and articles
- 11:2911:29, 18 December 2024 diff hist −7 KPUSE →Related tags and articles current
- 11:2911:29, 18 December 2024 diff hist −7 EINT →Related tags and articles current
- 11:2911:29, 18 December 2024 diff hist −7 NBMOD →Related tags and articles current Tag: Manual revert
- 11:2811:28, 18 December 2024 diff hist −7 IBAND No edit summary current