User contributions for Mmars
2 March 2011
- 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…'
- 15:3515:35, 1 March 2011 diff hist +90 N Category:Howto Created page with 'All Howto's will show up here. ---- Contents Howto'
28 February 2011
- 14:4714:47, 28 February 2011 diff hist −13 NOMEGAR No edit summary
- 14:4714:47, 28 February 2011 diff hist −13 NOMEGA No edit summary
- 14:4714:47, 28 February 2011 diff hist −13 LSPECTRAL No edit summary
- 14:4614:46, 28 February 2011 diff hist +113 N Category:GW Created page with 'Tags and articles that deal with the GW routines in VASP. ---- Contents GW'
- 14:4514:45, 28 February 2011 diff hist −13 Practical guide to GW calculations No edit summary
- 14:4514:45, 28 February 2011 diff hist −3 The VASP Manual →Howto's
- 14:4514:45, 28 February 2011 diff hist +34 N Talk:GW moved Talk:GW to Talk:GW calculations current
- 14:4514:45, 28 February 2011 diff hist 0 m Talk:Practical guide to GW calculations moved Talk:GW to Talk:GW calculations
- 14:4514:45, 28 February 2011 diff hist 0 m Practical guide to GW calculations moved GW to GW calculations
- 12:2812:28, 28 February 2011 diff hist −20 The VASP Manual →Howto's
- 12:2712:27, 28 February 2011 diff hist +1 Practical guide to GW calculations No edit summary
- 12:2312:23, 28 February 2011 diff hist +215 Talk:Practical guide to GW calculations No edit summary
- 12:1712:17, 28 February 2011 diff hist +16 Practical guide to GW calculations No edit summary
- 12:0012:00, 28 February 2011 diff hist −51 Practical guide to GW calculations No edit summary
- 11:4511:45, 28 February 2011 diff hist −2 The VASP Manual →Howto's
- 11:4411:44, 28 February 2011 diff hist 0 m Talk:Practical guide to GW calculations moved Talk:Frequency dependent GW calculations to Talk:GW over redirect: revert
- 11:4411:44, 28 February 2011 diff hist 0 m Practical guide to GW calculations moved Frequency dependent GW calculations to GW over redirect: revert
19 February 2011
- 12:2212:22, 19 February 2011 diff hist +1 LOPTICS No edit summary
18 February 2011
- 15:2915:29, 18 February 2011 diff hist +18 LEPSILON No edit summary
- 15:2515:25, 18 February 2011 diff hist +1,272 N LRPA Created page with '{{TAGDEF|LRPA|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: {{TAG|LRPA}}=.TRUE. includes local field effect on the Hartree level only. ---- For {{TAG|LRPA}}=.TRUE. local field eff…'
- 15:1515:15, 18 February 2011 diff hist +140 N Category:Linear response Created page with 'Tags and articles that deal with the linear response routines in VASP. ---- Contents Linear response'
- 15:1115:11, 18 February 2011 diff hist +17 CSHIFT →Related Tags and Sections
- 15:1115:11, 18 February 2011 diff hist +1,567 N LNABLA Created page with '{{TAGDEF|LNABLA|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: {{TAG|LNABLA}}=.TRUE. evaluates the transversal expression for the frequency dependent dielectric matrix. ---- Usuall…'
- 15:0515:05, 18 February 2011 diff hist +28 LOPTICS No edit summary
- 14:3814:38, 18 February 2011 diff hist +475 CSHIFT No edit summary
- 14:3614:36, 18 February 2011 diff hist +33 LOPTICS No edit summary
- 14:3614:36, 18 February 2011 diff hist +293 N CSHIFT Created page with '{{TAGDEF|CSHIFT|[real]|0.1}} Description: {{TAG|CSHIFT}} sets the (small) complex shift η in the Kramers-Kronig transformation. ---- == Related Tag…'
- 14:3114:31, 18 February 2011 diff hist +4 LOPTICS →Related Tags and Sections
- 14:3114:31, 18 February 2011 diff hist +12 LOPTICS →Related Tags and Sections
- 14:2914:29, 18 February 2011 diff hist −4 LOPTICS No edit summary
- 14:2314:23, 18 February 2011 diff hist +75 N Talk:LOPTICS Created page with 'Around the point where "GW" is mentioned we should link to future GW pages.' current
- 14:2214:22, 18 February 2011 diff hist +8 LOPTICS No edit summary
- 14:2014:20, 18 February 2011 diff hist +2 LOPTICS No edit summary
- 14:2014:20, 18 February 2011 diff hist +2,898 N LOPTICS Created page with '{{TAGDEF|LOPTICS|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: {{TAG|LOPTICS}}=.TRUE. calculates the frequency dependent dielectric matrix after the electronic ground state has be…'
17 February 2011
- 15:3215:32, 17 February 2011 diff hist +29 IALGO →Miscellaneous
- 15:1815:18, 17 February 2011 diff hist +1,926 LEPSILON No edit summary
- 15:0215:02, 17 February 2011 diff hist +1,469 LEPSILON No edit summary
- 14:5014:50, 17 February 2011 diff hist +2,210 N LEPSILON Created page with '{{TAGDEF|LEPSILON|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: {{TAG|LEPSILON}}=.TRUE. determines the static dielectric matrix, ion-clamped piezoelectric tensor and the Born effe…'
- 10:2010:20, 17 February 2011 diff hist −6 I CONSTRAINED M No edit summary
16 February 2011
- 17:3817:38, 16 February 2011 diff hist +1 M CONSTR No edit summary
- 17:3717:37, 16 February 2011 diff hist +58 M CONSTR No edit summary
- 17:3617:36, 16 February 2011 diff hist +110 M CONSTR No edit summary
- 17:3317:33, 16 February 2011 diff hist 0 M CONSTR No edit summary
- 17:3317:33, 16 February 2011 diff hist +28 M CONSTR No edit summary
- 17:2917:29, 16 February 2011 diff hist +639 M CONSTR No edit summary
- 17:0617:06, 16 February 2011 diff hist +7 M CONSTR No edit summary
- 17:0517:05, 16 February 2011 diff hist +98 M CONSTR No edit summary
- 17:0417:04, 16 February 2011 diff hist +513 N LAMBDA Created page with '{{TAGDEF|LAMBDA|[real]|0}} Description: {{TAG|LAMBDA}} sets the weight with which the penalty terms of the constrained local moment approach enter into the total energy expressi…'
- 16:5916:59, 16 February 2011 diff hist +311 N M CONSTR Created page with '{{TAGDEF|M_CONSTR|[real array]|none}} Description: {{TAG|M_CONSTR}} specifies the ---- == Related Tags and Sections == {{TAG|I_CONSTRAINED_M}}, {{TAG|LAMBDA}}, {{TAG|RWIGS}}, {…'
- 16:4716:47, 16 February 2011 diff hist −1 I CONSTRAINED M No edit summary
- 16:4616:46, 16 February 2011 diff hist +625 I CONSTRAINED M No edit summary
- 16:4416:44, 16 February 2011 diff hist +1,972 I CONSTRAINED M No edit summary
- 16:3516:35, 16 February 2011 diff hist +168 I CONSTRAINED M No edit summary
- 16:3216:32, 16 February 2011 diff hist +505 I CONSTRAINED M No edit summary
- 16:2616:26, 16 February 2011 diff hist +1,738 I CONSTRAINED M No edit summary
- 16:0516:05, 16 February 2011 diff hist +52 I CONSTRAINED M No edit summary
- 16:0016:00, 16 February 2011 diff hist +300 N I CONSTRAINED M Created page with '{{TAGDEF|I_CONSTRAINED_M|1 {{!}} 2|none}} Description: {{TAG|I_CONSTRAINED_M}} ---- == Related Tags and Sections == {{TAG|M_CONSTR}}, {{TAG|LAMBDA}}, {{TAG|RWIGS}}, {{TAG|LNONCO…'
- 15:2515:25, 16 February 2011 diff hist +8 RWIGS No edit summary
- 11:3511:35, 16 February 2011 diff hist −92 Talk:EVENONLY Blanked the page current
- 11:3411:34, 16 February 2011 diff hist +92 N Talk:EVENONLY Created page with 'This tag does not seem to exist in VASP (I checked). There is a tag EVENONLYGW, however ....'
- 11:3311:33, 16 February 2011 diff hist +1,867 N ODDONLY Created page with '{{TAGDEF|ODDONLY|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: {{TAG|ODDONLY}}=.TRUE. selects a subset of '''k'''-points for the representation of the Fock exchange potential, wit…'
- 11:2911:29, 16 February 2011 diff hist −15 NKREDZ No edit summary
- 11:2811:28, 16 February 2011 diff hist −15 NKREDY No edit summary
- 11:2811:28, 16 February 2011 diff hist −15 NKREDX No edit summary
- 11:2711:27, 16 February 2011 diff hist −14 NKRED No edit summary
- 11:2011:20, 16 February 2011 diff hist +6 EVENONLY No edit summary
- 11:2011:20, 16 February 2011 diff hist +1,865 N EVENONLY Created page with '{{TAGDEF|EVENONLY|.TRUE.|.FALSE.|.FALSE.}} Description: {{TAG|EVENONLY}}=.TRUE. selects a subset of '''k'''-points for the representation of the Fock exchange potential, with ''…'
15 February 2011
- 19:4919:49, 15 February 2011 diff hist −2 LSORBIT No edit summary
- 19:4919:49, 15 February 2011 diff hist +147 Talk:LSORBIT No edit summary current
- 19:4619:46, 15 February 2011 diff hist −1,126 LSORBIT No edit summary
- 18:4518:45, 15 February 2011 diff hist −4 LSORBIT No edit summary
- 18:4418:44, 15 February 2011 diff hist +9 LSORBIT No edit summary
- 18:4418:44, 15 February 2011 diff hist +1 LSORBIT No edit summary
- 18:4218:42, 15 February 2011 diff hist −101 LSORBIT No edit summary
- 18:0018:00, 15 February 2011 diff hist −2 LSORBIT No edit summary
- 17:5717:57, 15 February 2011 diff hist +22 LSORBIT No edit summary
- 17:5617:56, 15 February 2011 diff hist +5 N Talk:LSORBIT Created page with 'Cool!'
- 16:5916:59, 15 February 2011 diff hist +180 NKREDZ No edit summary
- 16:5916:59, 15 February 2011 diff hist +180 NKREDY No edit summary