User contributions for Mmars

12:3912:39, 1 February 2011 diff hist +21‎ LREAL ‎No edit summary
12:3412:34, 1 February 2011 diff hist +390‎ LREAL ‎No edit summary
12:2812:28, 1 February 2011 diff hist +296‎ N LREAL ‎ Created page with '{{TAGDEF|LREAL|.TRUE. {{!}} .FALSE. {{!}} On (or O) {{!}} Auto (or A)|.FALSE.}} Description: {{TAG|LREAL}} determines whether the projection operators are evaluated in real-spac…'
11:5511:55, 1 February 2011 diff hist +122‎ N Talk:NELECT ‎ Created page with 'The remarks about the homogeneous LDA electron gas: is this really all? Doesn't one need some special POTCAR file as well?' current
11:5511:55, 1 February 2011 diff hist +691‎ N NELECT ‎ Created page with '{{TAGDEF|NELECT|[real]|number of valence electrons}} Description: {{TAG|NELECT}} sets the number of electrons. ---- Usually you should not set this line. The number of electrons…'
11:0111:01, 1 February 2011 diff hist +45‎ N Talk:NBANDS ‎ Created page with 'NIONS and NMAG should be defined in the text.' current
10:3210:32, 1 February 2011 diff hist +1,609‎ N NBANDS ‎ Created page with '{{TAGDEF|NBANDS|[integer]}} {{DEF|NBANDS|{{TAG|NELECT}}/2+NIONS/2|non-spinpolarized|0.6*{{TAG|NELECT}}+NMAG|spinpolarized}} Description: {{TAG|NBANDS}} determines the actual num…'

17:1817:18, 31 January 2011 diff hist +14‎ IALGO ‎ →‎Related Tags and Sections
17:1617:16, 31 January 2011 diff hist +102‎ Talk:IALGO ‎No edit summary current
16:4916:49, 31 January 2011 diff hist −100‎ IALGO ‎ →‎References
16:4716:47, 31 January 2011 diff hist +1,656‎ IALGO ‎ →‎Direct optimization
16:4316:43, 31 January 2011 diff hist +68‎ Talk:IALGO ‎No edit summary
16:4216:42, 31 January 2011 diff hist +254‎ IALGO ‎No edit summary
16:3816:38, 31 January 2011 diff hist +1,101‎ IALGO ‎ →‎Direct optimization
16:2516:25, 31 January 2011 diff hist −16‎ IALGO ‎ →‎Direct optimization of the orbitals
16:2416:24, 31 January 2011 diff hist +2‎ IALGO ‎ →‎Direct optimization of the orbitals
16:2316:23, 31 January 2011 diff hist +2‎ IALGO ‎ →‎Direct optimization of the orbitals
16:2216:22, 31 January 2011 diff hist +875‎ IALGO ‎No edit summary
15:3215:32, 31 January 2011 diff hist +14‎ IALGO ‎ →‎Related Tags and Sections
15:2515:25, 31 January 2011 diff hist −1‎ IALGO ‎ →‎Conjugate gradient algorithms
15:2515:25, 31 January 2011 diff hist −34‎ IALGO ‎No edit summary
15:2315:23, 31 January 2011 diff hist +685‎ IALGO ‎ →‎Conjugate gradient algorithms
14:3814:38, 31 January 2011 diff hist +1,212‎ IALGO ‎ →‎Miscellaneous
14:3114:31, 31 January 2011 diff hist +152‎ IALGO ‎No edit summary
14:1714:17, 31 January 2011 diff hist +128‎ IALGO ‎No edit summary
14:1214:12, 31 January 2011 diff hist +4,968‎ IALGO ‎No edit summary
13:5713:57, 31 January 2011 diff hist −1‎ Talk:IALGO ‎No edit summary
13:5713:57, 31 January 2011 diff hist +2‎ Talk:IALGO ‎No edit summary
13:5713:57, 31 January 2011 diff hist +189‎ Talk:IALGO ‎No edit summary
13:4713:47, 31 January 2011 diff hist +909‎ IALGO ‎No edit summary
13:3913:39, 31 January 2011 diff hist 0‎ IALGO ‎No edit summary
13:3613:36, 31 January 2011 diff hist +2‎ IALGO ‎No edit summary
13:3613:36, 31 January 2011 diff hist +50‎ N Talk:IALGO ‎ Created page with 'We should add a reference to the Kosugi algorithm.'
13:0813:08, 31 January 2011 diff hist +512‎ IALGO ‎No edit summary
13:0513:05, 31 January 2011 diff hist +288‎ IALGO ‎No edit summary
13:0013:00, 31 January 2011 diff hist +960‎ IALGO ‎No edit summary
12:3612:36, 31 January 2011 diff hist +10‎ NELMIN ‎No edit summary
12:3612:36, 31 January 2011 diff hist +15‎ NELMIN ‎No edit summary
12:3512:35, 31 January 2011 diff hist +15‎ NELMDL ‎No edit summary
12:3512:35, 31 January 2011 diff hist +220‎ N IALGO ‎ Created page with '{{TAGDEF|IALGO|8 {{!}} 38 {{!}} 48}} {{DEF|IALGO|8|for VASP.4.4 and older|38|else (if {{TAG|ALGO}} is not set)}} Description: ---- == Related Tags and Sections == ---- [[The_…'
12:3012:30, 31 January 2011 diff hist +52‎ N Talk:ALGO ‎ Created page with 'GW, ACFDT, and MP2 are still missing in the section.' current
12:2712:27, 31 January 2011 diff hist −36‎ NELMIN ‎No edit summary
12:2512:25, 31 January 2011 diff hist +44‎ NELMIN ‎ →‎Related Tags and Sections
12:2312:23, 31 January 2011 diff hist +39‎ NELMIN ‎No edit summary
12:2212:22, 31 January 2011 diff hist +371‎ N NELMIN ‎ Created page with '{{TAGDEF|NELMIN|2}} Description: specifies the minimum number of electronic SC steps. ---- Generally you do not need to change this setting. In some cases (for instance MD's, o…'
10:3610:36, 31 January 2011 diff hist +933‎ NELMDL ‎No edit summary
10:2610:26, 31 January 2011 diff hist +106‎ NELMDL ‎No edit summary
10:2510:25, 31 January 2011 diff hist +168‎ N NELMDL ‎ Created page with '{{TAGDEF|NELMDL|[integer]}} {{DEF|NELMDL|-5|if {{TAG|ISTART}}=0, {{TAG|INIWAV}}=1, and {{TAG|IALGO}}=8|-12|if {{TAG|ISTART}}=0, {{TAG|INIWAV}}=1, and {{TAG|IALGO}}=48}}'

20:0920:09, 29 January 2011 diff hist +49‎ EDIFF ‎No edit summary
20:0420:04, 29 January 2011 diff hist +65‎ NELM ‎No edit summary

1 February 2011

31 January 2011

29 January 2011