User contributions for Schlipf

08:1608:16, 29 March 2024 diff hist +19‎ HILLS W ‎ →‎Related tags and articles current
08:1608:16, 29 March 2024 diff hist +19‎ HILLS H ‎ →‎Related tags and articles current
08:1608:16, 29 March 2024 diff hist +92‎ HILLSPOT ‎No edit summary current Tag: Visual edit: Switched
08:1408:14, 29 March 2024 diff hist +19‎ HILLS BIN ‎No edit summary current

15:3615:36, 2 February 2024 diff hist +19‎ EFERMI ‎ →‎Fixed Fermi energy
15:3515:35, 2 February 2024 diff hist +188‎ EFERMI ‎ →‎Fixed Fermi energy
15:2515:25, 2 February 2024 diff hist +1‎ EFERMI ‎No edit summary
15:2515:25, 2 February 2024 diff hist +1,132‎ EFERMI ‎No edit summary

10:3510:35, 25 October 2023 diff hist +543‎ Known issues ‎No edit summary

10:2710:27, 20 October 2023 diff hist +122‎ Improved dimer method ‎No edit summary
10:2510:25, 20 October 2023 diff hist −199‎ Category:Improved dimer method ‎ Redirected page to Improved dimer method current Tag: New redirect
10:2410:24, 20 October 2023 diff hist −34‎ STEP SIZE ‎No edit summary current
10:2410:24, 20 October 2023 diff hist −34‎ STEP MAX ‎No edit summary current
10:2410:24, 20 October 2023 diff hist −34‎ MINROT ‎No edit summary current
10:2410:24, 20 October 2023 diff hist −34‎ FINDIFF ‎No edit summary
10:2310:23, 20 October 2023 diff hist −34‎ DIMER DIST ‎No edit summary current
10:2310:23, 20 October 2023 diff hist −34‎ Improved dimer method ‎No edit summary
10:2210:22, 20 October 2023 diff hist 0‎ Category:Transition states ‎No edit summary
10:2210:22, 20 October 2023 diff hist +35‎ N Improved Dimer Method ‎ Schlipf moved page Improved Dimer Method to Improved dimer method current Tag: New redirect
10:2210:22, 20 October 2023 diff hist 0‎ m Improved dimer method ‎ Schlipf moved page Improved Dimer Method to Improved dimer method
10:2010:20, 20 October 2023 diff hist 0‎ Category:Mixing ‎ Changed redirect target from Category:Density Mixing to Category:Density mixing current Tag: Redirect target changed
10:1910:19, 20 October 2023 diff hist +31‎ Improved dimer method ‎No edit summary
10:1810:18, 20 October 2023 diff hist +31‎ Nudged elastic bands ‎No edit summary
10:0910:09, 20 October 2023 diff hist +31‎ SPRING ‎No edit summary current
10:0810:08, 20 October 2023 diff hist 0‎ STEP SIZE ‎No edit summary
10:0810:08, 20 October 2023 diff hist 0‎ STEP MAX ‎No edit summary
10:0810:08, 20 October 2023 diff hist 0‎ MINROT ‎No edit summary
10:0710:07, 20 October 2023 diff hist 0‎ FINDIFF ‎No edit summary
10:0710:07, 20 October 2023 diff hist 0‎ DIMER DIST ‎No edit summary
10:0710:07, 20 October 2023 diff hist 0‎ IMAGES ‎No edit summary
10:0610:06, 20 October 2023 diff hist 0‎ SPRING ‎No edit summary
10:0510:05, 20 October 2023 diff hist +118‎ Nudged elastic bands ‎ →‎Step 2
09:5909:59, 20 October 2023 diff hist −1‎ Optimizing the parallelization ‎ →‎Related tags an articles current
09:5909:59, 20 October 2023 diff hist +42‎ Optimizing the parallelization ‎No edit summary
09:5609:56, 20 October 2023 diff hist +36‎ N Construction:Command line arguments ‎ Schlipf moved page Construction:Command line arguments to Command-line arguments current Tag: New redirect
09:5609:56, 20 October 2023 diff hist 0‎ m Command-line arguments ‎ Schlipf moved page Construction:Command line arguments to Command-line arguments current
09:5109:51, 20 October 2023 diff hist 0‎ The VASP Manual ‎No edit summary
09:4909:49, 20 October 2023 diff hist 0‎ Nudged elastic bands ‎No edit summary
09:4909:49, 20 October 2023 diff hist 0‎ Improved dimer method ‎No edit summary Tag: Visual edit: Switched
09:4909:49, 20 October 2023 diff hist +41‎ N Category:Transition States ‎ Schlipf moved page Category:Transition States to Category:Transition states current Tag: New redirect
09:4909:49, 20 October 2023 diff hist 0‎ m Category:Transition states ‎ Schlipf moved page Category:Transition States to Category:Transition states
09:4809:48, 20 October 2023 diff hist +30‎ Intrinsic-reaction-coordinate calculations ‎No edit summary
09:4709:47, 20 October 2023 diff hist +32‎ The VASP Manual ‎No edit summary Tag: Visual edit: Switched
09:3809:38, 20 October 2023 diff hist −21‎ Nudged elastic bands ‎No edit summary
09:3109:31, 20 October 2023 diff hist −19‎ Nudged elastic bands ‎No edit summary
09:2809:28, 20 October 2023 diff hist +4‎ Nudged elastic bands ‎No edit summary
09:2509:25, 20 October 2023 diff hist +1,159‎ Nudged elastic bands ‎No edit summary
08:4808:48, 20 October 2023 diff hist +424‎ Nudged elastic bands ‎No edit summary
08:3808:38, 20 October 2023 diff hist +34‎ N Category:Elastic band method ‎ Schlipf moved page Category:Elastic band method to Nudged elastic bands current Tag: New redirect
08:3708:37, 20 October 2023 diff hist −32‎ IMAGES ‎No edit summary
08:3708:37, 20 October 2023 diff hist 0‎ Category:Transition states ‎No edit summary
08:3608:36, 20 October 2023 diff hist −62‎ Category:Transition states ‎No edit summary
08:2508:25, 20 October 2023 diff hist +97‎ Template:Cite ‎No edit summary
08:2308:23, 20 October 2023 diff hist +554‎ Template:Cite ‎No edit summary
08:1008:10, 20 October 2023 diff hist +4‎ IMAGES ‎No edit summary
08:0708:07, 20 October 2023 diff hist +317‎ IMAGES ‎ →‎File handling

13:4413:44, 19 October 2023 diff hist −250‎ IMAGES ‎No edit summary
13:3513:35, 19 October 2023 diff hist +72‎ IMAGES ‎ →‎File handling
10:3110:31, 19 October 2023 diff hist −4,999‎ IMAGES ‎No edit summary
10:1010:10, 19 October 2023 diff hist +178‎ Nudged elastic bands ‎No edit summary
09:5109:51, 19 October 2023 diff hist +22‎ LDIPOL ‎No edit summary
09:4409:44, 19 October 2023 diff hist −4‎ NELECT ‎No edit summary
09:3809:38, 19 October 2023 diff hist −18‎ NELECT ‎ →‎Use in the context of charged calculations
09:3109:31, 19 October 2023 diff hist −4‎ NELECT ‎No edit summary

11:1111:11, 18 October 2023 diff hist +1,499‎ IMAGES ‎No edit summary
11:1011:10, 18 October 2023 diff hist +34‎ Nudged elastic bands ‎No edit summary
11:0911:09, 18 October 2023 diff hist +2,561‎ N Nudged elastic bands ‎ Created page with "The nudged elastic band (NEB) method[1][2] is a technique used to calculate energy barriers in VASP. When employing this method, the SPRING parameter is set to a negative valu..."
10:4010:40, 18 October 2023 diff hist +7,404‎ N IMAGES ‎ Created page with "{{TAGDEF|IMAGES|[integer]|0}} Description: {{TAG|IMAGES}} defines how many instances of VASP are started. These instances execute VASP calculations in separate directories 01..."
10:3010:30, 18 October 2023 diff hist +88‎ Command-line arguments ‎No edit summary
10:2510:25, 18 October 2023 diff hist +1,487‎ Command-line arguments ‎ →‎--dry-run / -n
09:5309:53, 18 October 2023 diff hist +169‎ Command-line arguments ‎ →‎--version / -v
09:4809:48, 18 October 2023 diff hist +146‎ Command-line arguments ‎ →‎--link-line / -l
09:4509:45, 18 October 2023 diff hist +158‎ Command-line arguments ‎ →‎--cpp-options / -c
09:4209:42, 18 October 2023 diff hist +309‎ Command-line arguments ‎No edit summary
09:3009:30, 18 October 2023 diff hist +89‎ N Command-line arguments ‎ Created page with "== --cpp-options / -c == == --dry-run / -n == == --link-line / -l == == --version / -v =="
08:4408:44, 18 October 2023 diff hist −71‎ Computing the work function ‎No edit summary

14:5014:50, 17 October 2023 diff hist +41‎ BANDGAP ‎No edit summary
14:4914:49, 17 October 2023 diff hist −2‎ BANDGAP ‎No edit summary
13:4413:44, 17 October 2023 diff hist +1,576‎ BANDGAP ‎No edit summary
13:2413:24, 17 October 2023 diff hist −6‎ BANDGAP ‎No edit summary
13:2113:21, 17 October 2023 diff hist −11‎ BANDGAP ‎No edit summary
13:1813:18, 17 October 2023 diff hist +1,744‎ BANDGAP ‎No edit summary
12:2612:26, 17 October 2023 diff hist −49‎ Category:INCAR ‎ Redirected page to Category:INCAR tag current Tags: New redirect Visual edit: Switched
12:2112:21, 17 October 2023 diff hist +36‎ BANDGAP ‎No edit summary
12:2012:20, 17 October 2023 diff hist −1‎ BANDGAP ‎No edit summary
12:2012:20, 17 October 2023 diff hist +5‎ BANDGAP ‎No edit summary
12:1912:19, 17 October 2023 diff hist +266‎ BANDGAP ‎No edit summary
12:0512:05, 17 October 2023 diff hist −1,551‎ BANDGAP ‎No edit summary
11:5611:56, 17 October 2023 diff hist +3‎ BANDGAP ‎No edit summary
11:5311:53, 17 October 2023 diff hist +324‎ BANDGAP ‎No edit summary
11:4411:44, 17 October 2023 diff hist +114‎ N File:Bandgap.png ‎ Illustrates how the relative position of two bands changes a system from a semiconductor to a metal. current
11:3911:39, 17 October 2023 diff hist +114‎ N File:Bandgap.pdf ‎ Illustrates how the relative position of two bands changes a system from a semiconductor to a metal. current
11:3411:34, 17 October 2023 diff hist +2,542‎ N BANDGAP ‎ Created page with "{{TAGDEF|BANDGAP|COMPACT {{!}} WEIGHT {{!}} KPOINT|COMPACT}} Description: {{TAG|BANDGAP}} determines the verbosity of the output for reporting the bandgap to the OUTCAR file...."

12:0512:05, 12 October 2023 diff hist −1‎ Template:Cite ‎ remove whitespace

13:2013:20, 6 July 2023 diff hist +29‎ The VASP Manual ‎ →‎Featured topics

12:3112:31, 14 June 2023 diff hist +11‎ PRECFOCK ‎No edit summary
12:3112:31, 14 June 2023 diff hist −12‎ PREC ‎No edit summary Tag: Visual edit
12:3012:30, 14 June 2023 diff hist −4‎ PRECFOCK ‎No edit summary

08:2008:20, 30 May 2023 diff hist +42‎ EFERMI ‎No edit summary Tag: Visual edit
08:1408:14, 30 May 2023 diff hist −15‎ EFERMI ‎No edit summary

20:5220:52, 12 May 2023 diff hist −368‎ O atom ‎ →‎stdout current
20:4920:49, 12 May 2023 diff hist +1,767‎ N Template:SNIPPET ‎ Created page with "<includeonly><div class="snippet"> {{{1}}} {{{2}}} </div></includeonly><noinclude> == Example == {{SNIPPET| running on 8 total cores distrk: each k-point on 8 cores,..." current
20:4720:47, 12 May 2023 diff hist +403‎ N Template:Stdout ‎ Created page with ":{| cellpadding="5" cellspacing="0" border="1" |N|| iteration count |- |E|| total energy |- |dE|| change of total energy |- |d eps|| change of the eigenvalues (fixed potentia..." current

12:1012:10, 28 February 2023 diff hist −2‎ Known issues ‎No edit summary
10:3510:35, 28 February 2023 diff hist +727‎ Known issues ‎No edit summary

14:2814:28, 20 February 2023 diff hist +20‎ N VASP Wiki:EFERMI ‎ Schlipf moved page Vaspwiki:EFERMI to EFERMI current Tag: New redirect
14:2814:28, 20 February 2023 diff hist 0‎ m EFERMI ‎ Schlipf moved page Vaspwiki:EFERMI to EFERMI
14:2714:27, 20 February 2023 diff hist +29‎ N Construction:EFERMI ‎ Schlipf moved page Construction:EFERMI to Vaspwiki:EFERMI current Tag: New redirect
14:2714:27, 20 February 2023 diff hist 0‎ m EFERMI ‎ Schlipf moved page Construction:EFERMI to Vaspwiki:EFERMI

14:0214:02, 23 January 2023 diff hist +548‎ Known issues ‎No edit summary
13:4913:49, 23 January 2023 diff hist +143‎ EFIELD ‎No edit summary current

13:1013:10, 30 September 2022 diff hist +116‎ Construction:Wiki style guide ‎ →‎Numbers and units

07:5607:56, 26 July 2022 diff hist +301‎ Category:Parallelization ‎ →‎MPI setup current
07:5507:55, 26 July 2022 diff hist 0‎ N File:Bad process binding.png ‎No edit summary current
07:5507:55, 26 July 2022 diff hist 0‎ N File:Good process binding.png ‎No edit summary current
07:4807:48, 26 July 2022 diff hist +61‎ Category:Parallelization ‎ →‎Communication patterns
07:4107:41, 26 July 2022 diff hist 0‎ N File:Communication2.png ‎No edit summary current
07:4007:40, 26 July 2022 diff hist 0‎ File:Communication.png ‎ Schlipf uploaded a new version of File:Communication.png current
07:3507:35, 26 July 2022 diff hist 0‎ N File:Communication.png ‎No edit summary

06:4706:47, 20 July 2022 diff hist +4‎ LUSENCCL ‎No edit summary

15:3215:32, 19 July 2022 diff hist +51‎ NCSHMEM ‎No edit summary
15:3015:30, 19 July 2022 diff hist +281‎ N LUSENCCL ‎ Created page with "{{TAGDEF|LUSENCCL|[integer]|1 }} Description: {{TAG|LUSENCCL}} allows to deactivate the NVIDIA Collective Communications Library (NCCL) during runtime when the code was compi..."
15:2615:26, 19 July 2022 diff hist +2‎ NCSHMEM ‎No edit summary
15:2615:26, 19 July 2022 diff hist +228‎ N NCSHMEM ‎ Created page with "{{TAGDEF|NCORE|[integer]|1 }} Description: {{TAG|NCSHMEM}} determines the number of compute cores sharing the memory. ---- Category:Performance Category:VASP6Categ..."
15:2115:21, 19 July 2022 diff hist +53‎ Category:Parallelization ‎ →‎File handling
15:1415:14, 19 July 2022 diff hist +228‎ N NCORES PER BAND ‎ Created page with "{{TAGDEF|NCORES_PER_BAND|[integer]|1}} Description: {{TAG|NCORES_PER_BAND}} determines the number of compute cores that work on an individual orbital. {{NB|deprecated|Use the..." current
15:0915:09, 19 July 2022 diff hist +704‎ Category:Parallelization ‎ →‎Theory
15:0515:05, 19 July 2022 diff hist −1‎ VCAIMAGES ‎No edit summary current
15:0215:02, 19 July 2022 diff hist −1,050‎ VCAIMAGES ‎No edit summary
08:3308:33, 19 July 2022 diff hist +882‎ Category:Parallelization ‎ →‎Theory

06:0306:03, 20 June 2022 diff hist +1‎ Calculation of dimers ‎No edit summary current Tag: Visual edit: Switched

07:5807:58, 2 June 2022 diff hist +212‎ Category:Output files ‎No edit summary
07:5407:54, 2 June 2022 diff hist +442‎ N LH5 ‎ Created page with "{{TAGDEF|LH5|[logical]|.FALSE.}} Description: {{TAG|LH5}} determines whether the output is written to the legacy files ({{FILE|CHGCAR}}, {{FILE|CHG}}, {{FILE|WAVECAR}}) or th..." current
07:4907:49, 2 June 2022 diff hist +23‎ LCHARG ‎No edit summary current Tag: Visual edit: Switched
07:4807:48, 2 June 2022 diff hist +13‎ LWAVE ‎ →‎Related tags and articles current Tag: Visual edit: Switched
07:4707:47, 2 June 2022 diff hist +10‎ LWAVE ‎No edit summary Tag: Visual edit: Switched
07:4707:47, 2 June 2022 diff hist +13‎ LCHARGH5 ‎ →‎Related tags and articles current
07:4607:46, 2 June 2022 diff hist +395‎ N LWAVEH5 ‎ Created page with "{{TAGDEF|LWAVE|[logical]|{{TAG|LH5}}}} Description: {{TAG|LWAVEH5}} determines whether the wavefunctions are written to {{FILE|vaspwave.h5}} file at the end of a run. == Rel..." current
07:4507:45, 2 June 2022 diff hist +1‎ LWAVE ‎No edit summary
07:4507:45, 2 June 2022 diff hist +2‎ LCHARG ‎No edit summary Tag: Visual edit: Switched
07:4407:44, 2 June 2022 diff hist +375‎ N LCHARGH5 ‎ Created page with "{{TAGDEF|LCHARGH5|[logical]|{{TAG|LH5}}}} Description: {{TAG|LCHARGH5}} determines whether the charge densities are written to {{FILE|vaspwave.h5}}. == Related tags and arti..."
07:4307:43, 2 June 2022 diff hist +36‎ LCHARG ‎ →‎Related tags and articles
07:4207:42, 2 June 2022 diff hist +4‎ LWAVE ‎ →‎Related tags and articles Tag: Visual edit
07:4107:41, 2 June 2022 diff hist +32‎ LWAVE ‎No edit summary

13:3513:35, 30 May 2022 diff hist −1‎ m NBANDS ‎ →‎Many-body perturbation theory calculatioins current Tag: Visual edit

06:5506:55, 25 May 2022 diff hist +4‎ Optimizing the parallelization ‎ →‎Optimizing the parallelization
06:4906:49, 25 May 2022 diff hist +369‎ Optimizing the parallelization ‎ →‎Optimizing the parallelization

15:2715:27, 12 May 2022 diff hist 0‎ Category:Parallelization ‎ →‎Theory
15:2715:27, 12 May 2022 diff hist +1‎ Category:Parallelization ‎ →‎Theory
15:2615:26, 12 May 2022 diff hist −22‎ Category:Parallelization ‎ →‎Optimizing the parallelization
15:2315:23, 12 May 2022 diff hist +74‎ Category:Parallelization ‎ →‎OpenMP/OpenACC
15:2115:21, 12 May 2022 diff hist −100‎ Category:Parallelization ‎ →‎Optimizing the parallelization
15:1615:16, 12 May 2022 diff hist +5‎ Category:Parallelization ‎ →‎MPI setup
15:1415:14, 12 May 2022 diff hist −2‎ Category:Parallelization ‎ →‎MPI setup
15:1315:13, 12 May 2022 diff hist −3‎ Category:Parallelization ‎ →‎Basic parallelization
15:1315:13, 12 May 2022 diff hist +1,740‎ Category:Parallelization ‎ →‎Terminology in high-performance computing (HPC)
14:3814:38, 12 May 2022 diff hist +208‎ Category:Parallelization ‎No edit summary

07:5907:59, 27 April 2022 diff hist +2‎ KPOINTS ‎No edit summary
07:5407:54, 27 April 2022 diff hist +14‎ KPOINTS ‎ →‎Generalized regular meshes
07:3007:30, 27 April 2022 diff hist −643‎ KPOINTS ‎ →‎Generalized regular meshes

15:1415:14, 8 April 2022 diff hist +26‎ KPOINTS ‎No edit summary
14:1214:12, 8 April 2022 diff hist +21‎ KPOINTS ‎No edit summary
13:5613:56, 8 April 2022 diff hist +42‎ KPOINTS ‎ →‎Generalized regular meshes
13:5413:54, 8 April 2022 diff hist +87‎ KPOINTS ‎ →‎Automatic k-point mesh
13:5213:52, 8 April 2022 diff hist −640‎ KPOINTS ‎ →‎Automatic k-point mesh
13:2913:29, 8 April 2022 diff hist −267‎ KPOINTS ‎No edit summary
13:2413:24, 8 April 2022 diff hist +1‎ KPOINTS ‎ →‎Automatic k-mesh generation
13:2313:23, 8 April 2022 diff hist −314‎ KPOINTS ‎ →‎Band-structure calculations
12:4512:45, 8 April 2022 diff hist +139‎ KPOINTS ‎ →‎Band-structure calculations
12:1612:16, 8 April 2022 diff hist +404‎ KPOINTS ‎ →‎Band-structure calculations
11:5411:54, 8 April 2022 diff hist 0‎ KPOINTS ‎No edit summary
11:4011:40, 8 April 2022 diff hist −4,867‎ Parallelization ‎ Redirected page to Category:Parallelization current Tags: New redirect Visual edit: Switched
11:3411:34, 8 April 2022 diff hist +29‎ N Category:Parallelization ‎ Schlipf moved page Construction:Parallelization to Parallelization Tag: New redirect
11:3411:34, 8 April 2022 diff hist 0‎ m Parallelization ‎ Schlipf moved page Construction:Parallelization to Parallelization
11:3311:33, 8 April 2022 diff hist −4‎ Parallelization ‎No edit summary
11:2911:29, 8 April 2022 diff hist −12‎ KPOINTS ‎ →‎Symmetry reduction of the mesh
11:2811:28, 8 April 2022 diff hist +12‎ KPOINTS ‎ →‎Symmetry reduction of the mesh
11:2611:26, 8 April 2022 diff hist −517‎ KPOINTS ‎ →‎Symmetry reduction of the mesh
11:1111:11, 8 April 2022 diff hist −916‎ KPOINTS ‎ →‎Symmetry reduction of the mesh
09:5609:56, 8 April 2022 diff hist +1,350‎ KPOINTS ‎ →‎Symmetry reduction of the mesh
09:2509:25, 8 April 2022 diff hist +2,764‎ KPOINTS ‎ →‎Symmetry reduction of the mesh
07:0707:07, 8 April 2022 diff hist −1‎ KPOINTS ‎No edit summary
07:0407:04, 8 April 2022 diff hist +1‎ KPOINTS ‎ →‎Coordinate system
07:0307:03, 8 April 2022 diff hist +1‎ KPOINTS ‎ →‎Coordinate system
07:0207:02, 8 April 2022 diff hist +5‎ KPOINTS ‎ →‎Coordinate system
07:0007:00, 8 April 2022 diff hist −3‎ KPOINTS ‎ →‎Coordinate system
07:0007:00, 8 April 2022 diff hist +5‎ KPOINTS ‎ →‎Coordinate system
07:0007:00, 8 April 2022 diff hist −147‎ KPOINTS ‎ →‎Coordinate system
06:4906:49, 8 April 2022 diff hist −24‎ KPOINTS ‎ →‎Symmetry reduction of the mesh

19:5719:57, 7 April 2022 diff hist +64‎ KPOINTS ‎ →‎Regular k-point mesh
19:3519:35, 7 April 2022 diff hist −141‎ KPOINTS ‎ →‎Regular k-point mesh
18:0718:07, 7 April 2022 diff hist +8‎ KPOINTS ‎ →‎Explicit k-point mesh
18:0518:05, 7 April 2022 diff hist −7‎ KPOINTS ‎ →‎Explicit k-point mesh
18:0218:02, 7 April 2022 diff hist 0‎ KPOINTS ‎ →‎Coordinate system
15:3115:31, 7 April 2022 diff hist +27‎ LORBIT ‎No edit summary
15:3115:31, 7 April 2022 diff hist +27‎ KPOINTS OPT ‎No edit summary
15:3015:30, 7 April 2022 diff hist −1‎ KPOINTS ‎No edit summary
15:2915:29, 7 April 2022 diff hist +28‎ KPOINTS ‎No edit summary
15:2815:28, 7 April 2022 diff hist 0‎ KPOINTS ‎No edit summary
15:2715:27, 7 April 2022 diff hist −50‎ KPOINTS ‎ →‎Coordinate system
15:2415:24, 7 April 2022 diff hist −61‎ KPOINTS ‎ →‎Coordinate system
15:0515:05, 7 April 2022 diff hist +96‎ KPOINTS ‎ →‎Coordinate system
14:5714:57, 7 April 2022 diff hist +1‎ KPOINTS ‎ →‎Coordinate system
14:5714:57, 7 April 2022 diff hist 0‎ KPOINTS ‎ →‎Coordinate system
14:5614:56, 7 April 2022 diff hist +343‎ KPOINTS ‎ →‎Coordinate system
14:4914:49, 7 April 2022 diff hist −2‎ KPOINTS ‎ →‎Explicit k-point mesh
14:4914:49, 7 April 2022 diff hist −4,141‎ KPOINTS ‎No edit summary
14:4714:47, 7 April 2022 diff hist −360‎ KPOINTS ‎ →‎Explicit k-point mesh
14:3714:37, 7 April 2022 diff hist −1‎ Template:Cite ‎No edit summary
14:1214:12, 7 April 2022 diff hist +3,696‎ KPOINTS ‎ →‎Explicit k-point mesh
14:0814:08, 7 April 2022 diff hist +144‎ Template:Cite ‎No edit summary
14:0714:07, 7 April 2022 diff hist +128‎ Template:Cite ‎No edit summary
12:5112:51, 7 April 2022 diff hist +23‎ KPOINTS ‎No edit summary
12:4712:47, 7 April 2022 diff hist −5‎ KPOINTS ‎ →‎Entering all k-points explicitly
11:1411:14, 7 April 2022 diff hist +28‎ KPOINTS ‎No edit summary
11:1411:14, 7 April 2022 diff hist +4‎ KPOINTS ‎No edit summary
11:0911:09, 7 April 2022 diff hist −25‎ KPOINTS ‎ →‎Strings of k-points for bandstructure calculations
11:0811:08, 7 April 2022 diff hist −606‎ KPOINTS ‎No edit summary
11:0311:03, 7 April 2022 diff hist −1‎ KPOINTS ‎No edit summary
11:0311:03, 7 April 2022 diff hist +810‎ KPOINTS ‎No edit summary
10:5610:56, 7 April 2022 diff hist +300‎ Template:Cite ‎No edit summary
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

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

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

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