User contributions for Mmars

25 May 2011

• 16:5616:56, 25 May 2011 diff hist +475‎ N FERWE ‎ Created page with '{{TAGDEF|FERWE|[real array]}} Description: {{TAG|FERWE}} sets the occupancies of the states for {{TAG|ISMEAR}}=-2. ---- In case of spin-polarized calculations ({{TAG|ISPIN}}=2),…'
• 16:2216:22, 25 May 2011 diff hist +84‎ ISMEAR ‎No edit summary

24 May 2011

• 14:0614:06, 24 May 2011 diff hist −1‎ SIGMA ‎No edit summary

23 May 2011

• 20:2520:25, 23 May 2011 diff hist +205‎ N SIGMA ‎ Created page with '{{TAGDEF|SIGMA|[real]|0.2}} Description: {{TAG|SIGMA}} determines the width of the smearing in eV. ---- == Related Tags and Sections == {{TAG|ISMEAR}} ---- [[The_VASP_Manual|Con…'
• 16:5816:58, 23 May 2011 diff hist +743‎ ISMEAR ‎No edit summary
• 16:5116:51, 23 May 2011 diff hist +7‎ ISMEAR ‎No edit summary
• 16:4716:47, 23 May 2011 diff hist +2,554‎ ISMEAR ‎No edit summary
• 16:3416:34, 23 May 2011 diff hist +167‎ ISMEAR ‎No edit summary
• 16:2916:29, 23 May 2011 diff hist +484‎ ISMEAR ‎No edit summary
• 16:1216:12, 23 May 2011 diff hist +1‎ ISMEAR ‎No edit summary
• 16:1216:12, 23 May 2011 diff hist +710‎ ISMEAR ‎No edit summary
• 01:2601:26, 23 May 2011 diff hist +30‎ ISMEAR ‎No edit summary

22 May 2011

• 23:2023:20, 22 May 2011 diff hist +649‎ N ISMEAR ‎ Created page with '{{TAGDEF|ISMEAR|-5 {{!}} -4 {{!}} -3 {{!}} -2 {{!}} -1 {{!}} 0 {{!}} [integer]>0 |1}} Description: {{TAG|ISMEAR}} determines how the partial occupancies ''f''_n'''k'''…'

7 April 2011

• 09:0909:09, 7 April 2011 diff hist −11‎ LWRITE MMN AMN ‎No edit summary

6 April 2011

• 23:1423:14, 6 April 2011 diff hist +32‎ LWRITE MMN AMN ‎No edit summary
• 23:1323:13, 6 April 2011 diff hist +393‎ LWRITE MMN AMN ‎No edit summary
• 23:0923:09, 6 April 2011 diff hist +410‎ N LWRITE MMN AMN ‎ Created page with '{{TAGDEF|LWRITE_MMN_AMN|.TRUE. {{!}} .FALSE.}} {{DEF|LWRITE_MMN_AMN|.TRUE.|if {{TAG|LWANNIER90}}{{=}}.TRUE.|.FALSE.|otherwise}} Description: {{TAG|LWRITE_MMN_AMN}}=.TRUE. tells …'
• 22:5722:57, 6 April 2011 diff hist +757‎ LWANNIER90 RUN ‎No edit summary
• 22:3222:32, 6 April 2011 diff hist +24‎ LWANNIER90 ‎No edit summary
• 22:3122:31, 6 April 2011 diff hist +25‎ LWANNIER90 RUN ‎No edit summary
• 22:2822:28, 6 April 2011 diff hist +382‎ N LWANNIER90 RUN ‎ Created page with '{{TAGDEF|LWANNIER90_RUN|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: {{TAG|LWANNIER90_RUN}} runs <tt>wannier_setup</tt> (see {{TAG|LWANNIER90}}=.TRUE.) and subsequently executes …'

5 April 2011

• 14:2314:23, 5 April 2011 diff hist −22‎ LWANNIER90 ‎No edit summary
• 14:1814:18, 5 April 2011 diff hist +166‎ LWANNIER90 ‎No edit summary
• 14:1014:10, 5 April 2011 diff hist +16‎ LWANNIER90 ‎No edit summary
• 14:0914:09, 5 April 2011 diff hist +200‎ LWANNIER90 ‎No edit summary
• 14:0614:06, 5 April 2011 diff hist +2‎ LWANNIER90 ‎No edit summary
• 11:3911:39, 5 April 2011 diff hist 0‎ LWANNIER90 ‎No edit summary
• 11:3911:39, 5 April 2011 diff hist −35‎ LWANNIER90 ‎No edit summary
• 11:3811:38, 5 April 2011 diff hist +7‎ LWANNIER90 ‎No edit summary
• 11:3811:38, 5 April 2011 diff hist +35‎ LWANNIER90 ‎No edit summary
• 11:3611:36, 5 April 2011 diff hist +1‎ LWANNIER90 ‎No edit summary
• 11:3511:35, 5 April 2011 diff hist +2,124‎ LWANNIER90 ‎No edit summary
• 10:5610:56, 5 April 2011 diff hist +449‎ LWANNIER90 ‎No edit summary
• 10:4610:46, 5 April 2011 diff hist +116‎ LWANNIER90 ‎No edit summary
• 10:4310:43, 5 April 2011 diff hist +160‎ LWANNIER90 ‎No edit summary
• 10:4010:40, 5 April 2011 diff hist +290‎ LWANNIER90 ‎No edit summary
• 10:3310:33, 5 April 2011 diff hist +39‎ N LWANNIER90 ‎ Created page with '{{TAGDEF|LWANNIER90|[logical]|.FALSE.}}'

29 March 2011

• 23:4523:45, 29 March 2011 diff hist +940‎ N EBREAK ‎ Created page with '{{TAGDEF|EBREAK|[real]|{{TAG|EDIFF}}/{{TAG|NBANDS}}/4}} Description: {{TAG|EBREAK}} specifies an absolute stopping criterion for the optimization of an eigenvalue. ---- The tags…'
• 23:4123:41, 29 March 2011 diff hist −16‎ DEPER ‎ →‎Related Tags and Sections
• 23:3923:39, 29 March 2011 diff hist +4‎ DEPER ‎No edit summary
• 23:3823:38, 29 March 2011 diff hist +1,010‎ N DEPER ‎ Created page with '{{TAGDEF|DEPER|[real]|0.3}} Description: {{TAG|DEPER}} specifies a relative stopping criterion for optimization of an eigenvalue. ---- The tags {{TAG|DEPER}}, {{TAG|WEIMIN}}, an…'
• 23:3423:34, 29 March 2011 diff hist −21‎ WEIMIN ‎No edit summary
• 23:3223:32, 29 March 2011 diff hist +884‎ WEIMIN ‎No edit summary
• 23:2723:27, 29 March 2011 diff hist +354‎ N WEIMIN ‎ Created page with '{{TAGDEF|WEIMIN|[real]}} {{DEF|WEIMIN|0.001|for {{TAG|IBRION}}≥0|0|for {{TAG|IBRION}}{{=}}−1}} Description: {{TAG|WEIMIN}} specifies the maximum weight for a band to be…'
• 23:1823:18, 29 March 2011 diff hist −1‎ NSIM ‎ →‎Related Tags and Sections
• 23:1823:18, 29 March 2011 diff hist −1‎ NDAV ‎No edit summary
• 23:1723:17, 29 March 2011 diff hist +251‎ N NDAV ‎ Created page with '{{TAGDEF|NDAV|[integer]|4}} Description: {{TAG|NDAV}} sets the maximum number of iterative steps per bands per RMM-DIIS step ({{TAG|IALGO}}=4X). ---- == Related Tags and Section…'
• 23:0823:08, 29 March 2011 diff hist +1‎ NSIM ‎No edit summary
• 23:0823:08, 29 March 2011 diff hist +725‎ N NSIM ‎ Created page with '{{TAGDEF|NSIM|[integer]|4}} Description: {{TAG|NSIM}} sets the number of band that are optimized simultaneously by the RMM-DIIS algorithm. ---- The RMM-DIIS algorithm ({{TAG|IAL…'
• 22:5422:54, 29 March 2011 diff hist 0‎ NFREE ‎No edit summary