User contributions for Kresse
3 November 2021
- 17:0417:04, 3 November 2021 diff hist +6 m NATURALO No edit summary Tag: Visual edit
- 17:0317:03, 3 November 2021 diff hist +85 NATURALO NATURALO = 1 updated. Works properly for partial occupancies. Tag: Visual edit
18 October 2021
- 07:1207:12, 18 October 2021 diff hist +24 Band decomposed charge densities No edit summary
- 07:1107:11, 18 October 2021 diff hist +775 Band decomposed charge densities comment on spin polarized calculations added Tag: Visual edit
23 August 2021
- 11:2511:25, 23 August 2021 diff hist +421 IBRION →{{TAG|IBRION}}=7 and 8: second derivatives, Hessian matrix, and phonon frequencies (perturbation theory).
- 11:1311:13, 23 August 2021 diff hist +22 IBRION →{{TAG|IBRION}}=7 and 8: second derivatives, Hessian matrix, and phonon frequencies (perturbation theory).
- 11:1111:11, 23 August 2021 diff hist +3 IBRION →{{TAG|IBRION}}=7 and 8: second derivatives, Hessian matrix, and phonon frequencies (perturbation theory).
- 11:0911:09, 23 August 2021 diff hist +2,662 IBRION →{{TAG|IBRION}}=7 and 8: second derivatives, Hessian matrix, and phonon frequencies (perturbation theory).
16 June 2021
- 08:5908:59, 16 June 2021 diff hist +10 LUSE VDW →Related Tags and Sections
- 08:4008:40, 16 June 2021 diff hist +106 IVDW No edit summary Tag: Visual edit: Switched
- 08:3808:38, 16 June 2021 diff hist +160 LUSE VDW No edit summary Tag: Visual edit
- 08:3408:34, 16 June 2021 diff hist +189 LUSE VDW No edit summary Tag: Visual edit
- 08:3108:31, 16 June 2021 diff hist −4 LUSE VDW No edit summary Tag: Visual edit: Switched
- 08:3008:30, 16 June 2021 diff hist −1 LUSE VDW No edit summary Tag: Visual edit
- 08:2808:28, 16 June 2021 diff hist +114 LUSE VDW rVV10 added Tag: Visual edit
- 08:2408:24, 16 June 2021 diff hist +33 LUSE VDW No edit summary Tag: Visual edit: Switched
- 08:2108:21, 16 June 2021 diff hist +18 IVDW →Related Tags and Sections
7 June 2021
- 12:5312:53, 7 June 2021 diff hist +139 m EDIFF No edit summary Tag: Visual edit
- 08:3908:39, 7 June 2021 diff hist +17 EDIFF No edit summary
- 08:3908:39, 7 June 2021 diff hist +20 m EDIFF No edit summary Tag: Visual edit
18 May 2021
- 11:5611:56, 18 May 2021 diff hist +38 m ACFDT/RPA calculations No edit summary Tag: Visual edit
- 11:5411:54, 18 May 2021 diff hist 0 m ACFDT/RPA calculations →Recipe to Calculate ACFDT-RPA Total Energies in VASP.6 Tag: Visual edit
- 11:5411:54, 18 May 2021 diff hist +187 ACFDT/RPA calculations →Recipe to Calculate ACFDT-RPA Total Energies in VASP.6 Tag: Visual edit
- 07:0507:05, 18 May 2021 diff hist +27 ACFDT/RPA calculations →Recipe to Calculate ACFDT-RPA Total Energies in VASP.6 Tag: Visual edit
- 07:0507:05, 18 May 2021 diff hist +87 ACFDT/RPA calculations →Recipe to Calculate ACFDT-RPA Total Energies in VASP.6 Tag: Visual edit
- 07:0407:04, 18 May 2021 diff hist +220 m ACFDT/RPA calculations No edit summary Tag: Visual edit
- 06:5706:57, 18 May 2021 diff hist +484 ACFDT/RPA calculations Caveats of the vasp.6 approach explained (does not work for any range separated functional). Tag: Visual edit
- 06:3206:32, 18 May 2021 diff hist −7 m ACFDT/RPA calculations →Recipe to Calculate ACFDT-RPA Total Energies in VASP.6 Tag: Visual edit
- 06:3106:31, 18 May 2021 diff hist +265 m ACFDT/RPA calculations Recipe to Calculate ACFDT-RPA Total Energies in VASP.5 Tag: Visual edit
- 06:2406:24, 18 May 2021 diff hist +870 ACFDT/RPA calculations No edit summary
- 06:1206:12, 18 May 2021 diff hist +20 m ACFDT/RPA calculations →General Recipe to Calculate ACFDT-RPA Total Energies
- 06:1106:11, 18 May 2021 diff hist +1,118 ACFDT/RPA calculations More detailed explanation how to select the new all in one mode (as well as its caveats). Discussion how to select the old vasp.5, step-by-step behavior. Tag: Visual edit
17 May 2021
- 18:1118:11, 17 May 2021 diff hist −7 m LMODELHF No edit summary Tag: Visual edit
11 May 2021
- 11:5811:58, 11 May 2021 diff hist +27 m ML ICRITERIA No edit summary Tag: Visual edit
27 April 2021
- 06:5806:58, 27 April 2021 diff hist +4 HFRCUT No edit summary Tag: Visual edit
- 06:5706:57, 27 April 2021 diff hist +17 HFRCUT →Related Tags and Sections
- 06:5506:55, 27 April 2021 diff hist +6 m HFRCUT No edit summary Tag: Visual edit
- 06:5106:51, 27 April 2021 diff hist +19 m HFALPHA No edit summary Tag: Visual edit
- 06:4706:47, 27 April 2021 diff hist +105 m HFRCUT No edit summary Tag: Visual edit
- 06:4006:40, 27 April 2021 diff hist +788 N HFALPHA Created page with "{{TAGDEF|HFALPHA|[real]|-1}} Description: {{TAG|HFALPHA}} specifies how the Coulomb kernel is approximated at G=0 when the Fock energy and the exchange potential are evaluate..."
- 06:3006:30, 27 April 2021 diff hist +9 HFRCUT No edit summary
- 06:2906:29, 27 April 2021 diff hist +9 HFRCUT No edit summary
- 06:2806:28, 27 April 2021 diff hist +1 HFRCUT No edit summary
- 06:2806:28, 27 April 2021 diff hist +95 HFRCUT No edit summary
- 06:2606:26, 27 April 2021 diff hist +2,240 HFRCUT Major rewrite with explanation of the unterlying methods. Tag: Visual edit
26 April 2021
- 09:1709:17, 26 April 2021 diff hist +281 m HFRCUT No edit summary Tag: Visual edit
16 April 2021
- 10:5310:53, 16 April 2021 diff hist +4 m ML CX No edit summary Tag: Visual edit
- 10:5110:51, 16 April 2021 diff hist +56 m ML ICRITERIA No edit summary Tag: Visual edit
- 08:5008:50, 16 April 2021 diff hist +121 ML CX No edit summary Tag: Visual edit
- 08:3808:38, 16 April 2021 diff hist +80 ML CTIFOR No edit summary Tag: Visual edit
- 08:3608:36, 16 April 2021 diff hist −22 m ML ICRITERIA →Related Tags and Sections Tag: Visual edit
- 08:3508:35, 16 April 2021 diff hist −1 m ML CX No edit summary Tag: Visual edit
- 08:3408:34, 16 April 2021 diff hist +1,114 N ML CX Created page with "{{TAGDEF|ML_FF_XMIX|[integer]|0.5}} Description: The parameter determines how the threshold ({{TAG|ML_FF_CTIFOR}}) is updated in the machine learning force field methods. -..."
- 08:2408:24, 16 April 2021 diff hist −2 m ML ICRITERIA No edit summary Tag: Visual edit
- 08:2408:24, 16 April 2021 diff hist +329 ML ICRITERIA XMIX added Tag: Visual edit
- 08:1708:17, 16 April 2021 diff hist +2 m ML CSLOPE No edit summary Tag: Visual edit
- 08:1508:15, 16 April 2021 diff hist +18 m ML ICRITERIA No edit summary Tag: Visual edit
- 08:1408:14, 16 April 2021 diff hist +285 ML MHIS No edit summary Tag: Visual edit
- 07:2007:20, 16 April 2021 diff hist −13 ML CSLOPE No edit summary Tag: Visual edit
- 07:1907:19, 16 April 2021 diff hist +335 ML CSLOPE Rewritten for clarity Tag: Visual edit
- 07:1607:16, 16 April 2021 diff hist +1 m ML CSIG No edit summary Tag: Visual edit
- 07:1507:15, 16 April 2021 diff hist +168 ML ICRITERIA Further updates reference ML_FF_SLOPE added Tag: Visual edit
- 07:1107:11, 16 April 2021 diff hist +131 ML CSIG No edit summary Tag: Visual edit
- 07:0507:05, 16 April 2021 diff hist +470 ML ICRITERIA Added more extensive description Tag: Visual edit
- 07:0007:00, 16 April 2021 diff hist +22 ML ICRITERIA →Related Tags and Sections
- 07:0007:00, 16 April 2021 diff hist +73 ML ICRITERIA Rewritten for clarity Tag: Visual edit
14 April 2021
- 17:1117:11, 14 April 2021 diff hist +20 ML CSIG →Related Tags and Sections
- 17:1017:10, 14 April 2021 diff hist +20 ML CSLOPE →Related Tags and Sections
- 17:1017:10, 14 April 2021 diff hist −1 ML ICRITERIA →Related Tags and Sections
- 17:0917:09, 14 April 2021 diff hist +21 ML ICRITERIA →Related Tags and Sections Tag: Visual edit
26 March 2021
- 06:5206:52, 26 March 2021 diff hist +86 m PRECFOCK Updated description of Single Tag: Visual edit
- 06:5006:50, 26 March 2021 diff hist +126 PREC Added description of SingleN Tag: Visual edit
- 06:4606:46, 26 March 2021 diff hist +649 PRECFOCK Added description of Single and changed order in table Tag: Visual edit
16 February 2021
- 09:2909:29, 16 February 2021 diff hist −12 m LMODELHF No edit summary Tag: Visual edit
15 February 2021
- 18:2418:24, 15 February 2021 diff hist +20 m Available PAW potentials ENMAX linked to wiki Tag: Visual edit
- 18:1918:19, 15 February 2021 diff hist −2 Available PAW potentials Checked and updated GW table. Tag: Visual edit
- 17:5817:58, 15 February 2021 diff hist +17 m Available PAW potentials No edit summary Tag: Visual edit
- 17:5517:55, 15 February 2021 diff hist +1,720 Available PAW potentials Further small updates in text. Tag: Visual edit
- 17:2317:23, 15 February 2021 diff hist −199 Available PAW potentials Update of ENMAX, removal of POTCAR files that have been removed, and changed defaults (W_pv -> W_sv) Tag: Visual edit
- 16:4016:40, 15 February 2021 diff hist +831 Available PAW potentials →Recommended potentials for DFT calculations Tag: Visual edit
29 January 2021
- 10:5710:57, 29 January 2021 diff hist +49 Bethe-Salpeter-equations calculations No edit summary
- 10:2810:28, 29 January 2021 diff hist +1 OMEGAMAX No edit summary
- 10:2210:22, 29 January 2021 diff hist 0 OMEGAMAX No edit summary
- 10:2110:21, 29 January 2021 diff hist +1 OMEGAMAX No edit summary
- 10:2110:21, 29 January 2021 diff hist +31 OMEGAMAX No edit summary
- 10:2010:20, 29 January 2021 diff hist +1 OMEGAMAX No edit summary
- 10:2010:20, 29 January 2021 diff hist +879 OMEGAMAX No edit summary
- 10:1110:11, 29 January 2021 diff hist +273 OMEGAMAX No edit summary
- 10:0910:09, 29 January 2021 diff hist +18 Bethe-Salpeter-equations calculations →Related Tags and Sections
- 10:0810:08, 29 January 2021 diff hist +682 Bethe-Salpeter-equations calculations No edit summary
- 09:4009:40, 29 January 2021 diff hist +159 Bethe-Salpeter-equations calculations No edit summary
20 January 2021
- 15:5415:54, 20 January 2021 diff hist +200 LVTOT No edit summary
- 15:5215:52, 20 January 2021 diff hist +26 LVHAR No edit summary
- 15:5015:50, 20 January 2021 diff hist −81 LOCPOT No edit summary
- 15:4815:48, 20 January 2021 diff hist +152 LOCPOT No edit summary
- 15:4615:46, 20 January 2021 diff hist −378 LOCPOT No edit summary
22 December 2020
- 11:3511:35, 22 December 2020 diff hist +624 ALGO No edit summary
17 December 2020
- 15:4215:42, 17 December 2020 diff hist +15 INCAR No edit summary
- 15:4115:41, 17 December 2020 diff hist −25 INCAR No edit summary
- 15:3815:38, 17 December 2020 diff hist +497 INCAR No edit summary
- 15:3115:31, 17 December 2020 diff hist +5 INCAR No edit summary
15 December 2020
- 06:4506:45, 15 December 2020 diff hist +1 IALGO →RMM-DIIS
- 06:4506:45, 15 December 2020 diff hist +57 IALGO →RMM-DIIS
- 06:4406:44, 15 December 2020 diff hist +74 ALGO No edit summary
12 November 2020
- 10:4610:46, 12 November 2020 diff hist +17 ML MRB2 No edit summary
- 10:4210:42, 12 November 2020 diff hist +140 ML MRB2 No edit summary
11 November 2020
- 10:3710:37, 11 November 2020 diff hist +27 ML WTOTEN No edit summary
- 08:3608:36, 11 November 2020 diff hist +31 LREAL No edit summary
- 08:3408:34, 11 November 2020 diff hist +14 LREAL No edit summary
- 08:3208:32, 11 November 2020 diff hist +1 LREAL No edit summary
- 08:3108:31, 11 November 2020 diff hist −1 LREAL No edit summary
- 08:3008:30, 11 November 2020 diff hist +6 ROPT No edit summary
- 08:2608:26, 11 November 2020 diff hist +5 ROPT No edit summary
- 08:2508:25, 11 November 2020 diff hist +24 ROPT No edit summary
10 November 2020
- 10:0010:00, 10 November 2020 diff hist −18 ROPT No edit summary
- 09:5909:59, 10 November 2020 diff hist −21 ROPT No edit summary
- 09:5809:58, 10 November 2020 diff hist +271 ROPT No edit summary
- 09:5709:57, 10 November 2020 diff hist +371 ROPT No edit summary
- 09:5609:56, 10 November 2020 diff hist 0 ROPT No edit summary
- 09:5509:55, 10 November 2020 diff hist +87 ROPT No edit summary
- 09:5209:52, 10 November 2020 diff hist +71 LREAL Update to reflect current behavior of vasp.5 and vasp.6 (page was outdated)
- 09:3509:35, 10 November 2020 diff hist +24 LREAL No edit summary
- 09:3009:30, 10 November 2020 diff hist 0 ROPT No edit summary
- 09:2809:28, 10 November 2020 diff hist +42 LREAL No edit summary
- 09:2409:24, 10 November 2020 diff hist +290 ROPT No edit summary
- 08:4308:43, 10 November 2020 diff hist +265 ROPT No edit summary
- 08:3808:38, 10 November 2020 diff hist −64 ROPT No edit summary
- 08:3408:34, 10 November 2020 diff hist +7 ROPT No edit summary
- 08:3308:33, 10 November 2020 diff hist +57 ROPT No edit summary
6 November 2020
- 06:4206:42, 6 November 2020 diff hist +7 NATURALO No edit summary
- 06:3806:38, 6 November 2020 diff hist +2 NATURALO No edit summary
- 06:3706:37, 6 November 2020 diff hist +3 NATURALO No edit summary
5 November 2020
- 10:0710:07, 5 November 2020 diff hist +3 NATURALO No edit summary
- 10:0510:05, 5 November 2020 diff hist +27 NATURALO No edit summary
4 November 2020
- 16:0916:09, 4 November 2020 diff hist +295 NATURALO No edit summary
- 16:0116:01, 4 November 2020 diff hist +215 NATURALO No edit summary
- 15:5415:54, 4 November 2020 diff hist +150 NATURALO No edit summary
- 15:5015:50, 4 November 2020 diff hist −3 NATURALO No edit summary
- 15:4815:48, 4 November 2020 diff hist +164 NATURALO No edit summary
- 15:4015:40, 4 November 2020 diff hist +993 NATURALO No edit summary
- 15:0315:03, 4 November 2020 diff hist +152 NATURALO No edit summary
- 15:0015:00, 4 November 2020 diff hist −88 NATURALO No edit summary
- 10:0310:03, 4 November 2020 diff hist +390 NATURALO No edit summary
- 09:4309:43, 4 November 2020 diff hist +3 NATURALO No edit summary
- 09:4109:41, 4 November 2020 diff hist −10 NATURALO No edit summary
- 09:1009:10, 4 November 2020 diff hist +73 NATURALO No edit summary
- 08:5008:50, 4 November 2020 diff hist +2,327 NATURALO No edit summary
- 08:3308:33, 4 November 2020 diff hist +1 NATURALO No edit summary
- 08:3208:32, 4 November 2020 diff hist +6 NATURALO No edit summary
- 08:2708:27, 4 November 2020 diff hist +281 N NATURALO Created page with "{{TAGDEF|NATURALO|[integer]|.FALSE.}} Description: allows to calculate RPA natural orbitals. ---- == Related Tags and Sections == * {{TAG|ALGO}} for response functions and..."
3 November 2020
- 08:1608:16, 3 November 2020 diff hist +26 Not enough memory No edit summary
- 08:1308:13, 3 November 2020 diff hist +463 Not enough memory No edit summary
- 08:0908:09, 3 November 2020 diff hist +652 Not enough memory No edit summary
2 November 2020
- 17:4617:46, 2 November 2020 diff hist 0 Not enough memory No edit summary
- 17:4617:46, 2 November 2020 diff hist 0 Not enough memory No edit summary
- 17:4517:45, 2 November 2020 diff hist +84 Not enough memory No edit summary
- 17:4317:43, 2 November 2020 diff hist −63 Not enough memory No edit summary
- 17:3217:32, 2 November 2020 diff hist −948 Not enough memory No edit summary
14 October 2020
- 15:0315:03, 14 October 2020 diff hist +11 Category:Common Pitfalls No edit summary
- 15:0215:02, 14 October 2020 diff hist +30 Category:Common Pitfalls No edit summary
- 15:0115:01, 14 October 2020 diff hist +2,965 N Performance issues, try NCORE, KPAR, ALGO, LREAL Created page with "Many user have difficulties to make good choices for various computational and technical parameters, resulting in suboptimal performance. Here is a very brief outline which ta..."
- 15:0115:01, 14 October 2020 diff hist +11 Category:Common Pitfalls No edit summary
- 13:2913:29, 14 October 2020 diff hist +48 Category:Common Pitfalls No edit summary
- 13:1713:17, 14 October 2020 diff hist +13 NCORE No edit summary
- 12:3712:37, 14 October 2020 diff hist +6 NCORE No edit summary
- 12:3412:34, 14 October 2020 diff hist +19 NCORE No edit summary
- 12:2512:25, 14 October 2020 diff hist +24 NCORE No edit summary
- 12:1712:17, 14 October 2020 diff hist −22 NCORE No edit summary
- 12:0912:09, 14 October 2020 diff hist +258 NCORE No edit summary
- 11:2911:29, 14 October 2020 diff hist +74 Be careful with the default smearing method (ISMEAR=1) No edit summary
- 11:2811:28, 14 October 2020 diff hist +471 Be careful with the default smearing method (ISMEAR=1) No edit summary
- 11:2111:21, 14 October 2020 diff hist +84 N Be careful with the default smearing method (ISMEAR=1) Created page with "The default for {{TAG|ISMEAR}} is 2 in VASP. ---- Category:Calculational issues"
- 11:2011:20, 14 October 2020 diff hist +11 Category:Common Pitfalls No edit summary
- 11:1911:19, 14 October 2020 diff hist +43 Category:Common Pitfalls No edit summary
- 11:1711:17, 14 October 2020 diff hist +129 Number of bands NBANDS No edit summary
5 October 2020
- 08:1708:17, 5 October 2020 diff hist +90 ML CTIFOR No edit summary
- 08:1308:13, 5 October 2020 diff hist +27 ML CTIFOR No edit summary
- 07:4107:41, 5 October 2020 diff hist +1 ML CTIFOR No edit summary
- 07:4007:40, 5 October 2020 diff hist +4 ML CTIFOR No edit summary
- 07:4007:40, 5 October 2020 diff hist 0 ML CDOUB No edit summary
- 07:3907:39, 5 October 2020 diff hist −23 ML CDOUB No edit summary
- 07:3907:39, 5 October 2020 diff hist −7 ML CDOUB No edit summary
- 07:3807:38, 5 October 2020 diff hist −1 ML CDOUB No edit summary
- 07:3807:38, 5 October 2020 diff hist +2 ML CDOUB No edit summary
- 07:3707:37, 5 October 2020 diff hist +26 ML CDOUB No edit summary
- 07:3307:33, 5 October 2020 diff hist +24 ML CTIFOR →Related Tags and Sections
- 07:3107:31, 5 October 2020 diff hist −8 ML CTIFOR No edit summary
- 07:2907:29, 5 October 2020 diff hist +67 ML CTIFOR No edit summary
- 07:0407:04, 5 October 2020 diff hist −2 ML CTIFOR No edit summary
- 07:0207:02, 5 October 2020 diff hist +116 ML CTIFOR No edit summary
2 October 2020
- 06:3506:35, 2 October 2020 diff hist +154 ML IWEIGHT No edit summary
- 06:3006:30, 2 October 2020 diff hist 0 ML IWEIGHT No edit summary
- 06:3006:30, 2 October 2020 diff hist +71 ML IWEIGHT No edit summary
- 06:2906:29, 2 October 2020 diff hist +6 ML IWEIGHT No edit summary
- 06:2806:28, 2 October 2020 diff hist +2 ML IWEIGHT No edit summary
- 06:2806:28, 2 October 2020 diff hist +25 ML IWEIGHT No edit summary
- 06:0206:02, 2 October 2020 diff hist +453 ML IWEIGHT No edit summary
- 05:5305:53, 2 October 2020 diff hist +2 ML IWEIGHT No edit summary
- 05:5205:52, 2 October 2020 diff hist +325 ML IWEIGHT No edit summary
- 05:4805:48, 2 October 2020 diff hist +95 ML IWEIGHT No edit summary
30 September 2020
- 09:2509:25, 30 September 2020 diff hist +534 PRECFOCK No edit summary
- 08:5508:55, 30 September 2020 diff hist +1,618 PRECFOCK No edit summary
1 September 2020
- 16:1816:18, 1 September 2020 diff hist +340 ML EPS LOW No edit summary
20 August 2020
- 14:1114:11, 20 August 2020 diff hist +1,769 Validation tests No edit summary
- 08:2108:21, 20 August 2020 diff hist +875 Validation tests No edit summary
18 August 2020
- 07:0207:02, 18 August 2020 diff hist −2 ADDGRID No edit summary
- 07:0207:02, 18 August 2020 diff hist +171 ADDGRID No edit summary
- 06:5706:57, 18 August 2020 diff hist +977 ADDGRID No edit summary
12 May 2020
- 06:3006:30, 12 May 2020 diff hist +34 LASPH No edit summary
8 May 2020
- 11:5011:50, 8 May 2020 diff hist 0 LMODELHF No edit summary
- 11:4711:47, 8 May 2020 diff hist +737 LMODELHF No edit summary
- 09:4809:48, 8 May 2020 diff hist +54 LMODELHF No edit summary
- 09:4709:47, 8 May 2020 diff hist +637 LMODELHF No edit summary
- 09:2909:29, 8 May 2020 diff hist +18 LMODELHF No edit summary
- 09:2609:26, 8 May 2020 diff hist +204 LMODELHF No edit summary
- 09:1809:18, 8 May 2020 diff hist +1,541 LMODELHF No edit summary
- 08:4908:49, 8 May 2020 diff hist +24 LMODELHF No edit summary
- 08:4808:48, 8 May 2020 diff hist +212 LMODELHF No edit summary
- 08:1708:17, 8 May 2020 diff hist −37 LMODELHF No edit summary
- 08:1608:16, 8 May 2020 diff hist +1,604 N LMODELHF Created page with "{{TAGDEF|LMODELHF|.TRUE. {{!}} .FALSE.|.FALSE.}} Description: {{TAG|LMODELHF}} selects a decomposition of the exchange functional based on a range separated screening, with f..."
30 April 2020
- 06:5606:56, 30 April 2020 diff hist +462 ISMEAR No edit summary
20 April 2020
- 06:5306:53, 20 April 2020 diff hist +101 The VASP Manual No edit summary
16 April 2020
- 12:0512:05, 16 April 2020 diff hist +102 VCA No edit summary
- 12:0312:03, 16 April 2020 diff hist +89 VCA No edit summary
- 11:4211:42, 16 April 2020 diff hist +832 VCA No edit summary
- 11:2811:28, 16 April 2020 diff hist +310 VCA No edit summary
- 11:2011:20, 16 April 2020 diff hist +367 VCA No edit summary
- 11:1311:13, 16 April 2020 diff hist +110 VCA No edit summary
- 11:1111:11, 16 April 2020 diff hist +1,326 N VCA Created page with "{{TAGDEF|VCA|[real array]|read from the {{TAG|POTCAR}} file}} Description: {{TAG|VCA}} is short for the virtual crystal approximation; the tag allows to "weight" each species..."
31 March 2020
- 07:1607:16, 31 March 2020 diff hist +117 VCAIMAGES No edit summary
- 07:0007:00, 31 March 2020 diff hist +9 VCAIMAGES →Related Tags and Sections
- 07:0007:00, 31 March 2020 diff hist +1 VCAIMAGES →Related Tags and Sections
- 06:5906:59, 31 March 2020 diff hist +188 NCORE IN IMAGE1 No edit summary
- 06:5706:57, 31 March 2020 diff hist +714 VCAIMAGES No edit summary
- 06:2506:25, 31 March 2020 diff hist +1,449 VCAIMAGES No edit summary
12 August 2019
- 12:3612:36, 12 August 2019 diff hist +61 IALGO →Direct optimization
- 12:3412:34, 12 August 2019 diff hist +1,279 LSUBROT No edit summary
- 12:2312:23, 12 August 2019 diff hist +326 LSUBROT No edit summary
- 12:2012:20, 12 August 2019 diff hist −4 LSUBROT No edit summary
- 12:2012:20, 12 August 2019 diff hist +203 N LSUBROT Created page with "{TAGDEF|LSUBROT|.FALSE. {{!}} .TRUE. {{!}} {{DEF|SUBROT|.FALSE.|}} Description: {{TAG|LSUBROT}} determines whether an optimal rotation matrix between the occupied and unoccu..."
- 12:1512:15, 12 August 2019 diff hist +486 IALGO →Direct optimization: NELMDL documentation and cross reference
- 12:0312:03, 12 August 2019 diff hist +202 NELMDL No edit summary
- 11:5311:53, 12 August 2019 diff hist +1,859 NELMDL No edit summary
25 July 2019
- 14:3714:37, 25 July 2019 diff hist +78 Construction:Wiki style guide No edit summary
- 14:3414:34, 25 July 2019 diff hist +427 N Construction:Wiki style guide Created page with "This page is under construction * IMPLICIT NONE and INDENT(IN) and INTENT(OUT) must be used * When updating and working on existing routines follow exactly the style of ex..."
- 13:1913:19, 25 July 2019 diff hist +11 The VASP Manual No edit summary
2 April 2019
- 13:2213:22, 2 April 2019 diff hist −1 GGA moved RE upwards
25 February 2019
- 18:1218:12, 25 February 2019 diff hist +37 LFOCKAEDFT No edit summary
25 January 2019
- 16:4416:44, 25 January 2019 diff hist −136 PREC No edit summary
- 16:4216:42, 25 January 2019 diff hist +291 PREC No edit summary