User contributions for Mmars
23 May 2011
- 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''<sub>n'''k'''</sub>…'
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
- 22:5322:53, 29 March 2011 diff hist +18 NFREE No edit summary
- 22:5222:52, 29 March 2011 diff hist −7 NFREE No edit summary
- 22:5122:51, 29 March 2011 diff hist −8 NFREE No edit summary
- 22:4922:49, 29 March 2011 diff hist −1 SPRING No edit summary
- 22:4822:48, 29 March 2011 diff hist +2 NBLOCK No edit summary
- 22:4722:47, 29 March 2011 diff hist +10 KBLOCK No edit summary
- 22:4722:47, 29 March 2011 diff hist −4 NBLOCK No edit summary
- 22:4722:47, 29 March 2011 diff hist +4 NBLOCK →Related Tags and Sections
- 22:4522:45, 29 March 2011 diff hist −10 KBLOCK No edit summary
- 22:4522:45, 29 March 2011 diff hist −10 NBLOCK No edit summary