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User contributions for Schlipf

For Schlipf talk block log uploads logs

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

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

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

07:5807:58, 2 November 2021 diff hist +175‎ LOPTICS ‎No edit summary Tag: Visual edit: Switched

08:4608:46, 21 June 2021 diff hist +3‎ ALGO ‎ →‎ALGO for response functions and GW calculations and ACFDT/RPA calculations Tag: Visual edit

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

09:3409:34, 15 February 2021 diff hist +105‎ IVDW ‎No edit summary Tag: Visual edit: Switched

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

08:1508:15, 21 February 2020 diff hist +2‎ Fcc Si bandstructure ‎ →‎CALCULATION current

15:2915:29, 20 February 2020 diff hist −1‎ O atom ‎ →‎stdout
15:2715:27, 20 February 2020 diff hist 0‎ O atom ‎ →‎stdout

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

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

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..."

16:1516:15, 8 October 2019 diff hist −1‎ ISMEAR ‎No edit summary

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
11:4111:41, 23 August 2019 diff hist −587‎ Liquid Si - MLFF ‎ →‎Optimizing weights on energy, forces and stress
11:3711:37, 23 August 2019 diff hist +2‎ Liquid Si - MLFF ‎ →‎Obtaining more accurate force field
10:3910:39, 23 August 2019 diff hist −70‎ Liquid Si - MLFF ‎ →‎User task
10:3710:37, 23 August 2019 diff hist −308‎ Liquid Si - MLFF ‎ →‎Obtaining more accurate force field
09:4109:41, 23 August 2019 diff hist −206‎ Liquid Si - MLFF ‎ →‎Obtaining more accurate force field

16:3116:31, 22 August 2019 diff hist +185‎ Liquid Si - MLFF ‎ →‎Structral properties of the force field
16:1016:10, 22 August 2019 diff hist +3‎ Liquid Si - MLFF ‎ →‎Structral properties of the force field
16:0916:09, 22 August 2019 diff hist −7,190‎ Liquid Si - MLFF ‎ →‎Structral properties of the force field
14:5214:52, 22 August 2019 diff hist +150‎ Liquid Si - MLFF ‎ →‎Structral properties of the force field
14:2714:27, 22 August 2019 diff hist +48‎ Liquid Si - MLFF ‎No edit summary
14:2314:23, 22 August 2019 diff hist −3‎ Liquid Si - MLFF ‎ →‎Creating the liquid structure
13:4013:40, 22 August 2019 diff hist −13‎ Liquid Si - MLFF ‎ →‎{{TAG|POSCAR}}
13:3913:39, 22 August 2019 diff hist −312‎ Liquid Si - MLFF ‎No edit summary

13:0913:09, 10 May 2019 diff hist −794‎ LMIXTAU ‎No edit summary
13:0913:09, 10 May 2019 diff hist +828‎ N Kinetic-energy density mixing ‎ Created page with "For the density mixing schemes to work reliably, the charge density mixer must be aware of all quantities that affect the total energy during the self-consistency cycle. For a..." current
13:0113:01, 10 May 2019 diff hist +36‎ LMIXTAU ‎No edit summary
13:0013:00, 10 May 2019 diff hist +27‎ LMIXTAU ‎No edit summary

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