User contributions for Mmars
29 March 2011
- 22:4522:45, 29 March 2011 diff hist −10 NBLOCK No edit summary
- 22:3122:31, 29 March 2011 diff hist +24 TEEND No edit summary
- 22:3022:30, 29 March 2011 diff hist 0 TEEND No edit summary
- 22:3022:30, 29 March 2011 diff hist +309 N TEEND Created page with '{{TAGDEF|TEEND|[real]|{{TAG|TEBEG}}}} Description: {{TAG|TEBEG}} sets the final temperature for an ab-initio molecular dynamics run ({{TAG|IBRION}}=0). ---- == Related Tags and …'
- 22:2122:21, 29 March 2011 diff hist +16 TEBEG No edit summary
- 22:1922:19, 29 March 2011 diff hist +1,360 N TEBEG Created page with '{{TAGDEF|TEBEG|[real]|0}} Description: {{TAG|TEBEG}} sets the start temperature for an ab-initio molecular dynamics run ({{TAG|IBRION}}=0). ---- If no initial velocities are sup…'
- 19:2819:28, 29 March 2011 diff hist +14 NOMEGAR No edit summary
- 19:2719:27, 29 March 2011 diff hist +3 NOMEGAR No edit summary
- 19:2619:26, 29 March 2011 diff hist +8 NOMEGAR No edit summary
- 19:0319:03, 29 March 2011 diff hist +5 SMASS No edit summary
- 19:0319:03, 29 March 2011 diff hist +1 SMASS No edit summary
- 19:0219:02, 29 March 2011 diff hist −65 SMASS No edit summary
- 19:0019:00, 29 March 2011 diff hist +52 SMASS →References
- 18:5618:56, 29 March 2011 diff hist +12 SMASS →References
- 18:5518:55, 29 March 2011 diff hist +1 SMASS No edit summary
- 18:5418:54, 29 March 2011 diff hist +2,551 SMASS No edit summary
28 March 2011
- 10:2610:26, 28 March 2011 diff hist +176 SMASS No edit summary
- 08:3608:36, 28 March 2011 diff hist +186 N SMASS Created page with '{{TAGDEF|SMASS|-3 {{!}} -2 {{!}} -1 {{!}} [real] ≥ 0|-3}} Description: ---- == Related Tags and Sections == ---- Contents Category:INCAR[[Category:Dy…'
27 March 2011
- 19:3419:34, 27 March 2011 diff hist −5 The VASP Manual No edit summary
- 19:3319:33, 27 March 2011 diff hist +1 The VASP Manual No edit summary
- 19:3319:33, 27 March 2011 diff hist +4 The VASP Manual No edit summary
- 19:3119:31, 27 March 2011 diff hist +3 The VASP Manual No edit summary
- 16:3916:39, 27 March 2011 diff hist +63 The VASP Manual →Output
- 16:3716:37, 27 March 2011 diff hist +16 The VASP Manual →Output
- 16:3416:34, 27 March 2011 diff hist +1 The VASP Manual No edit summary
- 16:3416:34, 27 March 2011 diff hist −46 The VASP Manual No edit summary
- 16:3416:34, 27 March 2011 diff hist −25 The VASP Manual No edit summary
- 16:1116:11, 27 March 2011 diff hist +40 The VASP Manual →Output
- 16:0716:07, 27 March 2011 diff hist −5 The VASP Manual →Howto's
- 16:0616:06, 27 March 2011 diff hist −6 The VASP Manual →Getting started
- 16:0616:06, 27 March 2011 diff hist +22 The VASP Manual →Getting started
- 16:0516:05, 27 March 2011 diff hist +48 The VASP Manual →Getting started
- 16:0416:04, 27 March 2011 diff hist +19 The VASP Manual →Getting started
- 16:0316:03, 27 March 2011 diff hist +6 The VASP Manual →About this manual
- 16:0216:02, 27 March 2011 diff hist −38 The VASP Manual No edit summary
- 15:5815:58, 27 March 2011 diff hist −44 The VASP Manual No edit summary
- 15:5615:56, 27 March 2011 diff hist −3 The VASP Manual →Installation and validation
- 15:5515:55, 27 March 2011 diff hist +47 The VASP Manual No edit summary
- 15:5315:53, 27 March 2011 diff hist +139 The VASP Manual →Installation and validation
- 15:4615:46, 27 March 2011 diff hist −2 The VASP Manual →About this manual
- 15:4615:46, 27 March 2011 diff hist +1 The VASP Manual →About this manual
- 15:4515:45, 27 March 2011 diff hist +2 The VASP Manual →About this manual
- 15:4115:41, 27 March 2011 diff hist +18 The VASP Manual →Postprocessing
- 15:4015:40, 27 March 2011 diff hist +153 The VASP Manual No edit summary
- 15:3815:38, 27 March 2011 diff hist 0 The VASP Manual →Output
- 15:3715:37, 27 March 2011 diff hist −1 The VASP Manual →Output
- 15:3715:37, 27 March 2011 diff hist +15 The VASP Manual →Output
- 15:3615:36, 27 March 2011 diff hist +49 The VASP Manual →Output
- 15:3415:34, 27 March 2011 diff hist +155 The VASP Manual →Output
- 15:2815:28, 27 March 2011 diff hist +18 The VASP Manual →Output
- 15:2215:22, 27 March 2011 diff hist +27 The VASP Manual →Input
- 15:2115:21, 27 March 2011 diff hist +26 The VASP Manual →Input
- 15:2015:20, 27 March 2011 diff hist +9 The VASP Manual →Input
- 15:2015:20, 27 March 2011 diff hist −14 The VASP Manual →Input
- 15:2015:20, 27 March 2011 diff hist +32 The VASP Manual →Input
- 14:2314:23, 27 March 2011 diff hist +87 The VASP Manual →Further reading and additional documentation
- 14:2214:22, 27 March 2011 diff hist +45 The VASP Manual No edit summary
- 14:2214:22, 27 March 2011 diff hist +52 The VASP Manual No edit summary
- 14:1514:15, 27 March 2011 diff hist +10 The VASP Manual →The VASP workshop
- 14:1414:14, 27 March 2011 diff hist +37 The VASP Manual →Getting started
- 14:1314:13, 27 March 2011 diff hist −1,776 The VASP Manual No edit summary
- 14:1214:12, 27 March 2011 diff hist +1,848 N VASP workshop 2003 Created page with '=== Lectures === [http://cms.mpi.univie.ac.at/vasp-workshop/slides/comput_mat.pdf Introduction to Computational Materials] [http://cms.mpi.univie.ac.at/vasp-workshop/slides/dft_…'
- 14:0614:06, 27 March 2011 diff hist +91 N Category:Files Created page with 'All VASP input and output files. ---- Contents Files'
- 13:4513:45, 27 March 2011 diff hist −4 The VASP Manual →Exercises
- 13:4413:44, 27 March 2011 diff hist +657 The VASP Manual →The VASP workshop
- 13:3113:31, 27 March 2011 diff hist +1,001 The VASP Manual →Lectures
- 13:2313:23, 27 March 2011 diff hist +107 The VASP Manual →Lectures
- 13:1913:19, 27 March 2011 diff hist +199 The VASP Manual →The VASP workshop
- 13:1713:17, 27 March 2011 diff hist −2 The VASP Manual →Getting started
- 13:1513:15, 27 March 2011 diff hist +18 CHGCAR No edit summary
- 13:1413:14, 27 March 2011 diff hist +18 WAVECAR No edit summary
- 13:1413:14, 27 March 2011 diff hist +18 POTCAR No edit summary
- 13:1313:13, 27 March 2011 diff hist +18 INCAR No edit summary
- 13:0813:08, 27 March 2011 diff hist −86 The VASP Manual →Howto's
- 12:3512:35, 27 March 2011 diff hist +3,915 IBRION →Some general comments
- 12:2012:20, 27 March 2011 diff hist 0 IBRION →{{TAG|IBRION}}=44: the Improved Dimer Method
- 12:1812:18, 27 March 2011 diff hist +27 IBRION →{{TAG|IBRION}}=44
- 12:1612:16, 27 March 2011 diff hist −11 IBRION →{{TAG|IBRION}}=3: ionic relaxation (damped molecular dynamics).
- 12:1512:15, 27 March 2011 diff hist −1 IBRION →{{TAG|IBRION}}=1: ionic relaxation (RMM-DIIS).
- 12:1512:15, 27 March 2011 diff hist +2,538 IBRION No edit summary
26 March 2011
- 16:5216:52, 26 March 2011 diff hist +21 NFREE No edit summary
- 16:5116:51, 26 March 2011 diff hist +21 POTIM No edit summary
- 16:5016:50, 26 March 2011 diff hist +21 NSW No edit summary
- 16:5016:50, 26 March 2011 diff hist +136 N Category:Molecular Dynamics Created page with 'All tags and articles related to ionic relaxation and molecular dynamics. ---- Contents Dynamics'
- 16:4616:46, 26 March 2011 diff hist +1 IBRION →References
- 16:4516:45, 26 March 2011 diff hist +105 IBRION →References
- 16:2416:24, 26 March 2011 diff hist +42 IBRION →{{TAG|IBRION}}=5 and 6: second derivatives, Hessian matrix and phonon frequencies (finite differences).
- 16:2216:22, 26 March 2011 diff hist +188 IBRION →References
- 16:1816:18, 26 March 2011 diff hist −26 IBRION No edit summary
- 16:1616:16, 26 March 2011 diff hist +79 IBRION No edit summary
- 16:1216:12, 26 March 2011 diff hist +78 Talk:IBRION No edit summary current
- 16:1016:10, 26 March 2011 diff hist −2 IBRION →{{TAG|IBRION}}=7 and 8: second derivatives, Hessian matrix and phonon frequencies (perturbation theory).
- 16:0716:07, 26 March 2011 diff hist +43 IBRION No edit summary
- 16:0316:03, 26 March 2011 diff hist +609 IBRION →{{TAG|IBRION}}=7 and 8: second derivatives, Hessian matrix and phonon frequencies (perturbation theory).
- 15:5915:59, 26 March 2011 diff hist +4,643 IBRION No edit summary
- 14:2914:29, 26 March 2011 diff hist +1 IBRION →References
- 14:2914:29, 26 March 2011 diff hist +4 IBRION →References
- 14:2814:28, 26 March 2011 diff hist +1,897 IBRION No edit summary
- 13:5313:53, 26 March 2011 diff hist +190 IBRION No edit summary
- 13:0713:07, 26 March 2011 diff hist +4 IBRION No edit summary
- 13:0613:06, 26 March 2011 diff hist −2 IBRION No edit summary
- 12:4712:47, 26 March 2011 diff hist +8 IBRION No edit summary
- 12:4612:46, 26 March 2011 diff hist +1 IBRION No edit summary
- 12:4612:46, 26 March 2011 diff hist +2,846 IBRION No edit summary
- 12:3312:33, 26 March 2011 diff hist +187 N Talk:IBRION Created page with 'Is this still and issue: "...(or fourth-order predictor-corrector if VASP was linked with stepprecor.o)."? Maybe for vasp.4.X.X, the stepprecor.F file is not part of vasp.5.2.X a…'
- 12:3112:31, 26 March 2011 diff hist +661 IBRION No edit summary
- 12:0312:03, 26 March 2011 diff hist +1,620 N IBRION Created page with '{{TAGDEF|IBRION|-1 {{!}} 0 {{!}} 1 {{!}} 2 {{!}} 3 {{!}} 5 {{!}} 6 {{!}} 7 {{!}} 8 {{!}} 44}} {{DEF|IBRION|-1|for {{TAG|NSW}}{{=}}−1 or 0|0|else}} Description: {{TAG|IBRIO…'
25 March 2011
- 13:4313:43, 25 March 2011 diff hist +32 ENAUG No edit summary
- 13:3813:38, 25 March 2011 diff hist +191 ENAUG No edit summary
- 13:2713:27, 25 March 2011 diff hist +2 ENAUG No edit summary
- 13:2513:25, 25 March 2011 diff hist +270 N ENAUG Created page with '{{TAGDEF|ENAUG|[real]|set in accordance with ENCUT and PREC}} Description: ---- == Related Tags and Sections == {{TAG|NGXF}}, {{TAG|NGYF}}, {{TAG|NGZF}}, {{TAG|E…'
- 13:0913:09, 25 March 2011 diff hist +6 RWIGS →Related Tags and Sections
- 13:0813:08, 25 March 2011 diff hist −10 RWIGS No edit summary
- 12:4212:42, 25 March 2011 diff hist +90 The VASP Manual →About this manual
- 12:3212:32, 25 March 2011 diff hist −4 The VASP Manual →Howto's
- 12:2912:29, 25 March 2011 diff hist −37 INCAR No edit summary
- 12:2512:25, 25 March 2011 diff hist +421 INCAR No edit summary
- 12:0912:09, 25 March 2011 diff hist +4 Category:INCAR No edit summary
21 March 2011
- 10:0910:09, 21 March 2011 diff hist −86 EFIELD PEAD No edit summary
- 10:0810:08, 21 March 2011 diff hist +1 LCALCPOL No edit summary
20 March 2011
- 18:3118:31, 20 March 2011 diff hist +4 IPEAD No edit summary
- 18:0918:09, 20 March 2011 diff hist +146 IPEAD No edit summary
- 18:0218:02, 20 March 2011 diff hist +263 IPEAD No edit summary
- 17:5317:53, 20 March 2011 diff hist +24 LPEAD →Related Tags and Sections
- 17:5217:52, 20 March 2011 diff hist −15 IPEAD →Related Tags and Sections
- 17:5217:52, 20 March 2011 diff hist +327 N IPEAD Created page with '{{TAGDEF|IPEAD|1 {{!}} 2 {{!}} 3 {{!}} 4|4}} Description: ---- == Related Tags and Sections == {{TAG|LPEAD}}, {{TAG|LCALCEPS}}, {{TAG|EFIELD_PEAD}}, {{TAG|IPEAD}}, [[Berry_phase…'
- 17:4517:45, 20 March 2011 diff hist +330 LPEAD No edit summary
- 17:4117:41, 20 March 2011 diff hist +3 LPEAD No edit summary
- 17:3817:38, 20 March 2011 diff hist +2,561 N LPEAD Created page with '{{TAGDEF|LPEAD|.TRUE. {{!}} .FALSE|.FALSE.}} Description: for {{TAG|LPEAD}}=.TRUE., the derivative of the cell-periodic part of the orbitals w.r.t. '''k''', |∇<sub>'''k'''…'
- 17:1117:11, 20 March 2011 diff hist −7 LCALCPOL No edit summary
- 16:5816:58, 20 March 2011 diff hist −5 LCALCPOL No edit summary
- 16:5716:57, 20 March 2011 diff hist +17 LCALCPOL No edit summary
- 16:5516:55, 20 March 2011 diff hist +2,051 LCALCPOL No edit summary
- 16:3116:31, 20 March 2011 diff hist +48 EFIELD PEAD No edit summary
- 16:3016:30, 20 March 2011 diff hist +24 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 16:2516:25, 20 March 2011 diff hist +25 EFIELD PEAD →References
- 16:2316:23, 20 March 2011 diff hist +963 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 16:1816:18, 20 March 2011 diff hist +235 EFIELD PEAD No edit summary
- 16:1516:15, 20 March 2011 diff hist +149 EFIELD PEAD No edit summary
- 16:0516:05, 20 March 2011 diff hist +9,505 EFIELD PEAD No edit summary
- 15:2015:20, 20 March 2011 diff hist +264 EFIELD PEAD No edit summary
- 12:1612:16, 20 March 2011 diff hist +177 N EFIELD PEAD Created page with '{{TAGDEF|EFIELD_PEAD|[real array]}} {{DEF|EFIELD_PEAD|3*0.01|if {{TAG|LCALCEPS}}{{=}}.TRUE.|3*0.0|else}} Description: ---- ---- Contents Category:INCAR'
- 11:4011:40, 20 March 2011 diff hist +5 LCALCEPS No edit summary
- 11:3611:36, 20 March 2011 diff hist +448 LCALCEPS No edit summary
19 March 2011
- 17:4017:40, 19 March 2011 diff hist +1,030 LCALCEPS No edit summary
- 16:1216:12, 19 March 2011 diff hist +285 LCALCEPS No edit summary
- 14:1814:18, 19 March 2011 diff hist +585 LCALCEPS No edit summary
- 13:0013:00, 19 March 2011 diff hist −1 LCALCEPS No edit summary
- 13:0013:00, 19 March 2011 diff hist +1 LCALCEPS No edit summary
- 12:5912:59, 19 March 2011 diff hist +1 LCALCEPS No edit summary
- 12:5912:59, 19 March 2011 diff hist +966 LCALCEPS No edit summary
- 12:5012:50, 19 March 2011 diff hist +639 N LCALCEPS Created page with '{{TAGDEF|LCALCEPS|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: for {{TAG|LCALCEPS}}=.TRUE. the macroscopic ion-clamped static dielectric tensor, Born effective charge tensors, an…'
- 11:4611:46, 19 March 2011 diff hist −14 LCALCPOL No edit summary
- 11:4611:46, 19 March 2011 diff hist +14 LCALCPOL No edit summary
- 11:2911:29, 19 March 2011 diff hist 0 LCALCPOL →Related Tags and Sections
- 11:2911:29, 19 March 2011 diff hist +263 LCALCPOL No edit summary
- 11:2511:25, 19 March 2011 diff hist +263 LCALCPOL No edit summary
- 11:2211:22, 19 March 2011 diff hist −3 LCALCPOL No edit summary
- 11:2211:22, 19 March 2011 diff hist +13 LCALCPOL No edit summary
- 11:2111:21, 19 March 2011 diff hist +401 N LCALCPOL Created page with '{{TAGDEF|LCALCPOL|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: {{TAG|LCALCPOL}}=.TRUE. switches on the evaluation of the Berry phase expressions for the macroscopic electronic p…'
14 March 2011
- 10:2110:21, 14 March 2011 diff hist +1 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 10:2110:21, 14 March 2011 diff hist −1 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 10:2010:20, 14 March 2011 diff hist +47 Berry phases and finite electric fields →Self-consistent response to finite electric fields
12 March 2011
- 17:0217:02, 12 March 2011 diff hist +526 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 16:4516:45, 12 March 2011 diff hist +1 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 16:3616:36, 12 March 2011 diff hist −144 Berry phases and finite electric fields →Self-consistent response to finite electric fields
11 March 2011
- 14:5114:51, 11 March 2011 diff hist +1 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 14:4914:49, 11 March 2011 diff hist +16 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 14:4814:48, 11 March 2011 diff hist +102 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 14:4614:46, 11 March 2011 diff hist +2 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 14:4314:43, 11 March 2011 diff hist +348 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 14:3514:35, 11 March 2011 diff hist +527 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 12:4212:42, 11 March 2011 diff hist +20 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 12:3212:32, 11 March 2011 diff hist +2 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 12:1712:17, 11 March 2011 diff hist +816 Berry phases and finite electric fields No edit summary
10 March 2011
- 13:1313:13, 10 March 2011 diff hist +45 Berry phases and finite electric fields →References
- 13:0813:08, 10 March 2011 diff hist −146 Berry phases and finite electric fields →References
9 March 2011
- 11:4511:45, 9 March 2011 diff hist +1 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 11:4511:45, 9 March 2011 diff hist +1 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 11:4511:45, 9 March 2011 diff hist +1 Berry phases and finite electric fields →References
- 11:4511:45, 9 March 2011 diff hist +57 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 11:4411:44, 9 March 2011 diff hist +109 Berry phases and finite electric fields →References
- 11:4211:42, 9 March 2011 diff hist −4 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 11:1411:14, 9 March 2011 diff hist +389 Berry phases and finite electric fields No edit summary
- 10:4410:44, 9 March 2011 diff hist +1,599 Berry phases and finite electric fields →Self-consistent response to finite electric fields
- 10:0110:01, 9 March 2011 diff hist +111 Talk:GW recipes No edit summary current
- 09:5909:59, 9 March 2011 diff hist 0 Berry phases and finite electric fields →Related Tags and Sections
- 09:5809:58, 9 March 2011 diff hist +195 Berry phases and finite electric fields No edit summary
8 March 2011
- 18:4918:49, 8 March 2011 diff hist +5 Berry phases and finite electric fields →Computational aspects
- 18:4818:48, 8 March 2011 diff hist +131 Berry phases and finite electric fields →Computational aspects
- 18:4518:45, 8 March 2011 diff hist +138 Berry phases and finite electric fields →Computational aspects
- 18:3218:32, 8 March 2011 diff hist +1 Berry phases and finite electric fields No edit summary
- 18:1918:19, 8 March 2011 diff hist +593 Berry phases and finite electric fields No edit summary
7 March 2011
- 17:2417:24, 7 March 2011 diff hist +15 Practical guide to GW calculations →Recipes
- 17:2117:21, 7 March 2011 diff hist +16 Practical guide to GW calculations →Recipes
- 17:1817:18, 7 March 2011 diff hist +13 Practical guide to GW calculations →Recipes
- 17:1717:17, 7 March 2011 diff hist +15 Practical guide to GW calculations →Recipes
- 17:1717:17, 7 March 2011 diff hist 0 Practical guide to GW calculations →Recipes
- 17:1517:15, 7 March 2011 diff hist −108 Practical guide to GW calculations →Recipes
- 17:1517:15, 7 March 2011 diff hist +98 Practical guide to GW calculations →Recipes
- 15:4115:41, 7 March 2011 diff hist 0 Berry phases and finite electric fields →References
- 11:1211:12, 7 March 2011 diff hist +225 LMAXFOCKAE No edit summary
- 11:0211:02, 7 March 2011 diff hist −8 LMAXFOCKAE No edit summary
6 March 2011
- 16:2216:22, 6 March 2011 diff hist −1,509 Berry phases and finite electric fields No edit summary
- 16:0916:09, 6 March 2011 diff hist +143 Berry phases and finite electric fields No edit summary
- 15:3915:39, 6 March 2011 diff hist +6,380 Berry phases and finite electric fields No edit summary
- 15:0215:02, 6 March 2011 diff hist +31 Berry phases and finite electric fields No edit summary
- 15:0215:02, 6 March 2011 diff hist +38 Berry phases and finite electric fields No edit summary
- 14:5814:58, 6 March 2011 diff hist +77 Berry phases and finite electric fields No edit summary
- 14:3514:35, 6 March 2011 diff hist +5,612 Berry phases and finite electric fields No edit summary
- 14:0114:01, 6 March 2011 diff hist +1,006 Berry phases and finite electric fields →Berry phase expression for the macroscopic polarization
- 11:0311:03, 6 March 2011 diff hist +8 Berry phases and finite electric fields →Finite electric fields (the PEAD approach)
- 10:4110:41, 6 March 2011 diff hist +20 Berry phases and finite electric fields →Finite electric fields
3 March 2011
- 18:5318:53, 3 March 2011 diff hist +93 Berry phases and finite electric fields No edit summary
- 18:4518:45, 3 March 2011 diff hist +171 N Category:Berry phases Created page with 'All tags and articles that deal with Berry phase calculations and the PEAD are members of this category. ---- Contents Berry phases'
- 18:4218:42, 3 March 2011 diff hist +198 Berry phases and finite electric fields No edit summary
- 18:3918:39, 3 March 2011 diff hist +78 N Berry phases and finite electric fields Created page with '---- Contents Category:INCARCategory:Berry phases'
- 18:1718:17, 3 March 2011 diff hist +115 Talk:Main Page No edit summary current
- 12:4312:43, 3 March 2011 diff hist +27 Talk:Main Page No edit summary
2 March 2011
- 17:4517:45, 2 March 2011 diff hist +214 N Talk:Main Page Created page with 'We should install the following extensions: * Extension:Collection : allows users to create their own collections of pages (that may be exported as pdf) and maybe * Extension…'
- 15:0715:07, 2 March 2011 diff hist +4 LDAUTYPE No edit summary
- 13:5613:56, 2 March 2011 diff hist 0 LDAUTYPE No edit summary
- 13:5513:55, 2 March 2011 diff hist +632 LDAUTYPE No edit summary
- 13:5313:53, 2 March 2011 diff hist +32 LDAU No edit summary
- 13:5313:53, 2 March 2011 diff hist 0 LDAU No edit summary
- 13:5313:53, 2 March 2011 diff hist +600 LDAU No edit summary
- 13:4213:42, 2 March 2011 diff hist +400 LDAUTYPE No edit summary
- 13:4213:42, 2 March 2011 diff hist +400 LDAUU No edit summary
- 13:4213:42, 2 March 2011 diff hist +400 LDAUJ No edit summary
- 13:3713:37, 2 March 2011 diff hist 0 LEPSILON No edit summary
- 12:4212:42, 2 March 2011 diff hist +511 N LDAUPRINT Created page with '{{TAGDEF|LDAUPRINT|0 {{!}} 1 {{!}} 2|0}} Description: {{TAG|LDAUPRINT}} controls the verbosity of the L(S)DA+U routines. ---- *{{TAG|LDAUPRINT}}=0: silent. *{{TAG|LDAUPRINT}}=1:…'
- 12:1512:15, 2 March 2011 diff hist +398 N LDAUJ Created page with '{{TAGDEF|LDAUJ|[real array]|NTYP*0.0}} Description: {{TAG|LDAUJ}} specifies the strength of the effective on-site exchange interactions. ---- '''Mind''': one ''has'' to specify …'
- 12:1412:14, 2 March 2011 diff hist +397 N LDAUU Created page with '{{TAGDEF|LDAUU|[real array]|NTYP*0.0}} Description: {{TAG|LDAUU}} specifies the strength of the effective on-site Coulomb interactions. ---- '''Mind''': one ''has'' to specify o…'
- 12:0612:06, 2 March 2011 diff hist +462 N LDAUL Created page with '{{TAGDEF|LDAUL|[integer array]|NTYP*2}} Description: {{TAG|LDAUL}} specifies the ''l''-quantum number for which the on-site interaction is added. ---- For {{TAG|LDAUL}}=-1 no on…'
- 11:5211:52, 2 March 2011 diff hist 0 LDAUTYPE No edit summary
- 11:5111:51, 2 March 2011 diff hist +495 LDAUTYPE No edit summary
- 11:1111:11, 2 March 2011 diff hist −1 LDAUTYPE No edit summary
1 March 2011
- 20:5020:50, 1 March 2011 diff hist 0 LDAUTYPE No edit summary
- 20:4920:49, 1 March 2011 diff hist +37 LDAUTYPE No edit summary
- 20:4720:47, 1 March 2011 diff hist +44 LDAUTYPE No edit summary
- 20:4320:43, 1 March 2011 diff hist −1 LDAUTYPE No edit summary
- 20:4220:42, 1 March 2011 diff hist −2 LDAUTYPE No edit summary
- 20:4020:40, 1 March 2011 diff hist +1,086 LDAUTYPE No edit summary
- 20:2620:26, 1 March 2011 diff hist −1 LDAUTYPE No edit summary
- 20:1820:18, 1 March 2011 diff hist +95 N Category:DFT+U Created page with 'L(S)DA+U related tags and articles. ---- Contents LDA+U'
- 20:1720:17, 1 March 2011 diff hist +4 LDAUTYPE No edit summary
- 20:1520:15, 1 March 2011 diff hist +2,922 LDAUTYPE No edit summary
- 19:3119:31, 1 March 2011 diff hist −4 LDAUTYPE →References
- 19:3119:31, 1 March 2011 diff hist +1,115 N LDAUTYPE Created page with '{{TAGDEF|LDAUTYPE|1 {{!}} 2 {{!}} 4|2}} Description: {{TAG|LDAUTYPE}} specifies which type of L(S)DA+U approach will be used. ---- *{{TAG|LDAUTYPE}}=1: The rotationally invarian…'
- 19:1919:19, 1 March 2011 diff hist +294 N LDAU Created page with '{{TAGDEF|LDAU|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: {{TAG|LDAU}}=.TRUE. switches on the L(S)DA+U. ---- == Related Tags and Sections == {{TAG|LDAUTYPE}}, {{TAG|LDAUL}}, {{T…'