User contributions for Mmars
1 February 2011
- 16:1616:16, 1 February 2011 diff hist +2 ROPT No edit summary
- 16:1516:15, 1 February 2011 diff hist +1,549 ROPT No edit summary
- 15:4315:43, 1 February 2011 diff hist +70 ROPT No edit summary
- 15:3815:38, 1 February 2011 diff hist +962 ROPT No edit summary
- 15:2015:20, 1 February 2011 diff hist +1,054 LREAL No edit summary
- 15:1415:14, 1 February 2011 diff hist +13 ROPT →Related Tags and Sections
- 15:1315:13, 1 February 2011 diff hist −92 ROPT No edit summary
- 15:1015:10, 1 February 2011 diff hist +70 Template:DEF No edit summary current
- 15:0515:05, 1 February 2011 diff hist +1,320 N ROPT Created page with '{{TAGDEF|ROPT|[real array], one entry for each species on the {{FILE|POTCAR}} file}} {{DEF|ROPT|0.67|if {{TAG|LREAL}}{{=}}On and {{TAG|PREC}}{{=}}Low|1.0|if {{TAG|LREAL}}{{=}}On …'
- 14:0814:08, 1 February 2011 diff hist −8 LREAL No edit summary
- 14:0514:05, 1 February 2011 diff hist +924 LREAL No edit summary
- 13:4113:41, 1 February 2011 diff hist +1 LREAL No edit summary
- 13:4013:40, 1 February 2011 diff hist +226 LREAL No edit summary
- 13:3613:36, 1 February 2011 diff hist +1,575 LREAL No edit summary
- 13:2213:22, 1 February 2011 diff hist +26 LREAL →Related Tags and Sections
- 13:1013:10, 1 February 2011 diff hist +819 LREAL No edit summary
- 13:0713:07, 1 February 2011 diff hist +55 PREC →Intro
- 13:0513:05, 1 February 2011 diff hist +25 LREAL No edit summary
- 13:0013:00, 1 February 2011 diff hist +492 LREAL No edit summary
- 12:4812:48, 1 February 2011 diff hist +1 LREAL No edit summary
- 12:4812:48, 1 February 2011 diff hist +312 LREAL No edit summary
- 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…'
31 January 2011
- 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