User contributions for Cesare

9 June 2012

• 16:0316:03, 9 June 2012 diff hist +504‎ Si bandstructure ‎No edit summary
• 15:5815:58, 9 June 2012 diff hist +17‎ Si bandstructure ‎No edit summary
• 15:5715:57, 9 June 2012 diff hist +128‎ Si bandstructure ‎No edit summary
• 15:5515:55, 9 June 2012 diff hist +211‎ Si bandstructure ‎No edit summary
• 15:4615:46, 9 June 2012 diff hist +364‎ Si bandstructure ‎No edit summary
• 15:4115:41, 9 June 2012 diff hist +83‎ Si bandstructure ‎No edit summary
• 15:3915:39, 9 June 2012 diff hist −327‎ Si bandstructure ‎No edit summary
• 15:3215:32, 9 June 2012 diff hist +33‎ Si bandstructure ‎No edit summary
• 15:3115:31, 9 June 2012 diff hist +27‎ Si bandstructure ‎No edit summary
• 15:2415:24, 9 June 2012 diff hist +742‎ Si bandstructure ‎No edit summary
• 15:2015:20, 9 June 2012 diff hist +317‎ Si bandstructure ‎No edit summary
• 15:1015:10, 9 June 2012 diff hist +4‎ Bandstructure of Si in GW (VASP2WANNIER90) ‎ →‎Download
• 12:4312:43, 9 June 2012 diff hist −3‎ Bandstructure of Si in GW (VASP2WANNIER90) ‎ →‎Step 4: WANNIER90
• 12:4112:41, 9 June 2012 diff hist −4‎ Bandstructure of Si in GW (VASP2WANNIER90) ‎No edit summary
• 12:3812:38, 9 June 2012 diff hist +676‎ Bandstructure of Si in GW (VASP2WANNIER90) ‎No edit summary
• 12:2112:21, 9 June 2012 diff hist +3,265‎ Bandstructure of Si in GW (VASP2WANNIER90) ‎No edit summary
• 12:0412:04, 9 June 2012 diff hist +2,735‎ N Bandstructure of Si in GW (VASP2WANNIER90) ‎ Created page with 'Description: calculation of the bandstructure of Si in GW using the VASP2WANNIER90 interface. '''Mind''': The procedure to compute bandstructure in GW using V2W is almost identi…'
• 11:5111:51, 9 June 2012 diff hist +46‎ Si bandstructure ‎No edit summary

8 June 2012

• 15:4515:45, 8 June 2012 diff hist −11‎ MgO optimum mixing ‎No edit summary
• 15:4515:45, 8 June 2012 diff hist +171‎ MgO optimum mixing ‎No edit summary
• 15:4215:42, 8 June 2012 diff hist +4‎ MgO optimum mixing ‎No edit summary
• 15:4115:41, 8 June 2012 diff hist +160‎ MgO optimum mixing ‎No edit summary
• 15:3515:35, 8 June 2012 diff hist +312‎ Bandgap of Si using different DFT+HF methods ‎No edit summary
• 15:2815:28, 8 June 2012 diff hist 0‎ MgO optimum mixing ‎ →‎Download
• 15:2815:28, 8 June 2012 diff hist 0‎ Bandgap of Si using different DFT+HF methods ‎No edit summary
• 15:2415:24, 8 June 2012 diff hist +100‎ Si bandstructure ‎No edit summary
• 15:1715:17, 8 June 2012 diff hist −3‎ Si bandstructure ‎No edit summary
• 15:1715:17, 8 June 2012 diff hist +269‎ Si bandstructure ‎No edit summary
• 15:1415:14, 8 June 2012 diff hist +156‎ Si bandstructure ‎No edit summary
• 15:1315:13, 8 June 2012 diff hist +6‎ Si bandstructure ‎No edit summary
• 15:1215:12, 8 June 2012 diff hist −44‎ Si bandstructure ‎No edit summary
• 15:1115:11, 8 June 2012 diff hist +43‎ Si bandstructure ‎No edit summary
• 15:0915:09, 8 June 2012 diff hist +3,457‎ Si bandstructure ‎No edit summary
• 15:0115:01, 8 June 2012 diff hist +1,947‎ Si bandstructure ‎No edit summary
• 14:5614:56, 8 June 2012 diff hist +1‎ Si bandstructure ‎No edit summary
• 14:5514:55, 8 June 2012 diff hist −1‎ Si bandstructure ‎No edit summary
• 14:5414:54, 8 June 2012 diff hist +653‎ Si bandstructure ‎No edit summary
• 14:5014:50, 8 June 2012 diff hist +10‎ Si bandstructure ‎No edit summary
• 14:4914:49, 8 June 2012 diff hist +3,590‎ Si bandstructure ‎No edit summary
• 14:4814:48, 8 June 2012 diff hist +1,122‎ Si bandstructure ‎No edit summary
• 14:4514:45, 8 June 2012 diff hist +20‎ Si bandstructure ‎No edit summary
• 14:4314:43, 8 June 2012 diff hist +78‎ Si bandstructure ‎No edit summary
• 14:4314:43, 8 June 2012 diff hist −50‎ Si bandstructure ‎No edit summary
• 14:3814:38, 8 June 2012 diff hist +899‎ N Si bandstructure ‎ Created page with 'Description: Bandstructure for Si within DFT+HF ---- *INCAR <pre> ## Do a HSE hybrid functional banstructure ## calculation with (i) the KPOINTS.HSE.G-X file ## and (2) using V…'
• 14:0914:09, 8 June 2012 diff hist 0‎ MgO optimum mixing ‎ →‎Download
• 14:0114:01, 8 June 2012 diff hist +254‎ MgO optimum mixing ‎No edit summary
• 08:5908:59, 8 June 2012 diff hist 0‎ Bandgap of Si using different DFT+HF methods ‎ →‎Download
• 08:5608:56, 8 June 2012 diff hist +980‎ N MgO optimum mixing ‎ Created page with 'Description: find optimum HSE mixing parameter for MgO ---- *INCAR <pre> ############################################## ## Optimum HSE mixing parameter (AEXX) for MgO ## Expt g…'
• 08:3208:32, 8 June 2012 diff hist 0‎ Bandgap of Si using different DFT+HF methods ‎ →‎Download
• 08:3008:30, 8 June 2012 diff hist +1,394‎ N Bandgap of Si using different DFT+HF methods ‎ Created page with 'Description: Bandgap of Si using different DFT+HF schemes (PBE, B3LYP, PBE0, HSE06, and HF) ---- *INCAR <pre> ## Better preconverge with PBE first! ## Selects the B3LYP hybrid …'