User contributions for Schlipf
7 April 2022
- 10:4310:43, 7 April 2022 diff hist +122 KPOINTS No edit summary
- 09:4509:45, 7 April 2022 diff hist +5 KPOINTS →Regular k-point mesh
- 09:4509:45, 7 April 2022 diff hist +496 KPOINTS No edit summary
- 08:5508:55, 7 April 2022 diff hist +117 Category:Interface pinning →How to
- 08:4708:47, 7 April 2022 diff hist −72 Category:Interface pinning No edit summary
- 08:4608:46, 7 April 2022 diff hist −2 Category:Interface pinning →How to
- 08:4008:40, 7 April 2022 diff hist +198 Category:Interface pinning No edit summary
- 07:3407:34, 7 April 2022 diff hist −31 RANDOM SEED No edit summary
6 April 2022
- 14:3014:30, 6 April 2022 diff hist +59 KPOINTS No edit summary
- 14:1714:17, 6 April 2022 diff hist +26,782 N KPOINTS Created page with "The {{FILE|KPOINTS}} file is used to specify the Bloch vectors (k-points) that will be used to sample the Brillouin zone in your calculation. There are several different ways..."
- 13:5413:54, 6 April 2022 diff hist +52 Performance issues, try NCORE, KPAR, ALGO, LREAL No edit summary current
- 13:4213:42, 6 April 2022 diff hist +146 Parallelization →Additional parallelization options
- 13:3813:38, 6 April 2022 diff hist +28 NCORE IN IMAGE1 No edit summary
- 13:3413:34, 6 April 2022 diff hist +115 Parallelization →Additional parallelization options
- 13:3113:31, 6 April 2022 diff hist −52 NATURALO No edit summary
- 13:2513:25, 6 April 2022 diff hist +447 Parallelization →OpenMP/OpenACC
- 13:1013:10, 6 April 2022 diff hist +180 Parallelization →Additional parallelization options
- 13:0413:04, 6 April 2022 diff hist +70 Parallelization →Optimizing the parallelization
- 13:0313:03, 6 April 2022 diff hist +946 Parallelization →Caveat about the MPI setup
- 12:3812:38, 6 April 2022 diff hist +1,805 Parallelization No edit summary
- 08:0508:05, 6 April 2022 diff hist +1,013 N Parallelization Created page with "For many complex problems, a single core is not enough to finish the calculation in a reasonable time. VASP makes use of parallel machines splitting the calculation into many..."
- 07:5807:58, 6 April 2022 diff hist +28 OpenACC GPU port of VASP No edit summary Tag: Visual edit: Switched
30 March 2022
- 13:0013:00, 30 March 2022 diff hist −9 EFERMI No edit summary
- 12:5812:58, 30 March 2022 diff hist +3 EFERMI No edit summary
- 12:5412:54, 30 March 2022 diff hist +73 EFERMI No edit summary
- 12:5312:53, 30 March 2022 diff hist +197 EFERMI No edit summary
- 08:0508:05, 30 March 2022 diff hist +1,151 N EFERMI Created page with "{{TAGDEF|EFERMI|MIDGAP {{!}} LEGACY {{!}} [real]|MIDGAP}} Description: Defines how the Fermi energy is calculated in VASP. ---- For semiconducting materials, the Fermi ener..."
- 07:5707:57, 30 March 2022 diff hist 0 EMIN No edit summary Tag: Visual edit: Switched
- 07:4007:40, 30 March 2022 diff hist +20 STOP ON No edit summary
23 March 2022
- 11:5211:52, 23 March 2022 diff hist −5 INCAR No edit summary
- 08:5108:51, 23 March 2022 diff hist +5 m INCAR No edit summary Tag: Visual edit
- 08:4608:46, 23 March 2022 diff hist +448 INCAR No edit summary Tag: Visual edit: Switched
2 November 2021
- 07:5807:58, 2 November 2021 diff hist +175 LOPTICS No edit summary Tag: Visual edit: Switched
21 June 2021
- 08:4608:46, 21 June 2021 diff hist +3 ALGO →ALGO for response functions and GW calculations and ACFDT/RPA calculations Tag: Visual edit
26 March 2021
- 11:4111:41, 26 March 2021 diff hist +717 N Construction talk:Wiki style guide Created page with "== Spelling == * I would prefer PAWs over PAW's. * I'm not so sure about {{VASP}} in small caps. Using a template is a good idea, though. == Footnotes, links and references..." current
15 February 2021
- 09:3409:34, 15 February 2021 diff hist +105 IVDW No edit summary Tag: Visual edit: Switched
9 September 2020
- 09:3809:38, 9 September 2020 diff hist −22 NSTORB No edit summary
- 09:3709:37, 9 September 2020 diff hist −22 MP2 No edit summary
21 February 2020
- 08:1508:15, 21 February 2020 diff hist +2 Fcc Si bandstructure →CALCULATION current
20 February 2020
- 15:2915:29, 20 February 2020 diff hist −1 O atom →stdout
- 15:2715:27, 20 February 2020 diff hist 0 O atom →stdout
14 January 2020
- 10:1510:15, 14 January 2020 diff hist +43 ISTART No edit summary
- 10:1410:14, 14 January 2020 diff hist +105 ISTART No edit summary
29 November 2019
- 13:5613:56, 29 November 2019 diff hist −3 NUPDOWN No edit summary
- 13:4913:49, 29 November 2019 diff hist +9 NUPDOWN No edit summary
28 November 2019
- 15:2715:27, 28 November 2019 diff hist +766 N STOP ON Created page with "{{TAGDEF|STOP_ON|Error{{!}}Alert|Error}} Description: {{TAG|STOP_ON}} defines if the code should stop on errors only or also on alerts. ---- There are two instances, why on..."
8 October 2019
- 16:1516:15, 8 October 2019 diff hist −1 ISMEAR No edit summary
23 August 2019
- 13:2413:24, 23 August 2019 diff hist +1 Liquid Si - MLFF →Obtaining a more accurate force field
- 13:1813:18, 23 August 2019 diff hist −16 Liquid Si - MLFF →Production runs using the optimized parameters
- 11:5711:57, 23 August 2019 diff hist −305 Liquid Si - MLFF →Optimizing weights of energy, forces and stress