User contributions for Huebsch

21 October 2024

• 11:3611:36, 21 October 2024 diff hist −41‎ LMAXMIX ‎No edit summary current
• 11:3511:35, 21 October 2024 diff hist +49‎ PRJCAR ‎No edit summary current
• 11:3511:35, 21 October 2024 diff hist −12‎ LKPROJ ‎No edit summary current
• 11:3411:34, 21 October 2024 diff hist −7‎ KSPACING ‎No edit summary current
• 11:3411:34, 21 October 2024 diff hist −7‎ KGAMMA ‎No edit summary current
• 11:3311:33, 21 October 2024 diff hist −18‎ Integrating over all orbitals ‎No edit summary
• 11:3211:32, 21 October 2024 diff hist +5,523‎ N Category:Crystal momentum ‎ Created page with "A crystal is characterized by the fact that it obeys translational symmetry. In many calculations, we only consider the primitive crystal unit cell to save computational time. However in a realistic bulk material, interactions go beyond the primitive unit cell. The concept of '''crystal momentum''' is crucial in order to take into account interactions that go beyond the primitive unit cell during the simulation and it is a consequence of translational invariance. Fo..." current
• 08:0708:07, 21 October 2024 diff hist +6‎ Construction:Efficient single band eigenvalue-minimization ‎No edit summary current
• 08:0608:06, 21 October 2024 diff hist 0‎ m Construction:Efficient single band eigenvalue-minimization ‎ Huebsch moved page Efficient single band eigenvalue-minimization to Construction:Efficient single band eigenvalue-minimization without leaving a redirect
• 07:5507:55, 21 October 2024 diff hist −40‎ Harris-Foulkes functional ‎No edit summary current

18 October 2024

• 12:5312:53, 18 October 2024 diff hist −5‎ IBRION ‎ →‎Computing the phonon modes
• 11:4411:44, 18 October 2024 diff hist 0‎ Molecular dynamics calculations ‎No edit summary
• 11:3511:35, 18 October 2024 diff hist −36‎ IMIX ‎No edit summary current
• 11:3311:33, 18 October 2024 diff hist +6‎ LELF ‎No edit summary current
• 10:2810:28, 18 October 2024 diff hist 0‎ Time-propagation algorithms in molecular dynamics ‎ →‎Related tags and articles current
• 10:2710:27, 18 October 2024 diff hist −208‎ Time-propagation algorithms in molecular dynamics ‎No edit summary
• 10:2110:21, 18 October 2024 diff hist 0‎ m Time-propagation algorithms in molecular dynamics ‎ Huebsch moved page Construction:Molecular dynamics propagation algorithms to Time-propagation algorithms in molecular dynamics without leaving a redirect
• 10:2010:20, 18 October 2024 diff hist −12‎ Construction:IBRION ‎ →‎Molecular dynamics
• 10:1910:19, 18 October 2024 diff hist −5‎ Construction:IBRION ‎ →‎Computing the phonon modes
• 10:1710:17, 18 October 2024 diff hist −52‎ Construction:IBRION ‎No edit summary
• 10:1210:12, 18 October 2024 diff hist +1,319‎ Construction:IBRION ‎No edit summary
• 10:0210:02, 18 October 2024 diff hist +40‎ N Linear response ‎ Redirected page to Category:Linear response current Tag: New redirect
• 08:2708:27, 18 October 2024 diff hist +44‎ LNOAUGXC ‎No edit summary
• 07:3607:36, 18 October 2024 diff hist +16‎ ICHARG ‎ →‎Related tags and articles
• 07:1907:19, 18 October 2024 diff hist +33‎ ICHARG ‎No edit summary
• 07:1807:18, 18 October 2024 diff hist +16‎ Vasp.lock ‎No edit summary current
• 07:1807:18, 18 October 2024 diff hist +20‎ GAMMA ‎No edit summary
• 07:1707:17, 18 October 2024 diff hist +33‎ GAMMA ‎No edit summary
• 07:1407:14, 18 October 2024 diff hist +27‎ Vasp.lock ‎No edit summary
• 07:1307:13, 18 October 2024 diff hist 0‎ m Vasp.lock ‎ Huebsch moved page Construction:Vasp.lock to Vasp.lock without leaving a redirect
• 07:1307:13, 18 October 2024 diff hist +35‎ Vasp.lock ‎No edit summary
• 07:1107:11, 18 October 2024 diff hist +44‎ GAMMA ‎No edit summary
• 07:1007:10, 18 October 2024 diff hist 0‎ m GAMMA ‎ Huebsch moved page Construction:GAMMA to GAMMA without leaving a redirect

17 October 2024

• 14:5614:56, 17 October 2024 diff hist +8‎ LAECHG ‎No edit summary current
• 14:5414:54, 17 October 2024 diff hist −36‎ LCHARGH5 ‎No edit summary current
• 14:5414:54, 17 October 2024 diff hist −36‎ MAXMIX ‎No edit summary current
• 14:5314:53, 17 October 2024 diff hist +14‎ NWRITE ‎No edit summary current
• 14:5114:51, 17 October 2024 diff hist −36‎ NWRITE ‎No edit summary
• 14:5114:51, 17 October 2024 diff hist −36‎ LMIXTAU ‎No edit summary
• 14:4914:49, 17 October 2024 diff hist −41‎ MIXPRE ‎No edit summary current
• 14:4914:49, 17 October 2024 diff hist −37‎ PLEVEL ‎No edit summary current
• 14:4714:47, 17 October 2024 diff hist −3‎ RWIGS ‎No edit summary current
• 14:4514:45, 17 October 2024 diff hist 0‎ WC ‎No edit summary current
• 14:4414:44, 17 October 2024 diff hist −41‎ WC ‎No edit summary
• 14:4314:43, 17 October 2024 diff hist −41‎ SYSTEM ‎No edit summary current
• 14:4314:43, 17 October 2024 diff hist −5‎ WEIMIN ‎No edit summary current
• 14:4114:41, 17 October 2024 diff hist −29‎ LMAXPAW ‎No edit summary current
• 14:3314:33, 17 October 2024 diff hist −5‎ LNMR SYM RED ‎No edit summary
• 14:3314:33, 17 October 2024 diff hist +1‎ LNMR SYM RED ‎No edit summary
• 14:2914:29, 17 October 2024 diff hist −36‎ LVTOT ‎No edit summary current