User contributions for Csheldon

31 July 2024

• 14:1814:18, 31 July 2024 diff hist 0‎ Pulay stress ‎No edit summary
• 13:2513:25, 31 July 2024 diff hist +1‎ Volume relaxation ‎ →‎How to correct
• 13:2313:23, 31 July 2024 diff hist −56‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 13:2313:23, 31 July 2024 diff hist +217‎ Pulay stress ‎No edit summary
• 13:1313:13, 31 July 2024 diff hist +5‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 13:1213:12, 31 July 2024 diff hist +8‎ Pulay stress ‎ →‎Introduction
• 13:1113:11, 31 July 2024 diff hist −4‎ Pulay stress ‎No edit summary
• 13:0913:09, 31 July 2024 diff hist +8‎ Pulay stress ‎ →‎More detail explanation
• 13:0813:08, 31 July 2024 diff hist +4‎ Construction:VASP from Gaussian type orbitals ‎ →‎Introduction
• 13:0713:07, 31 July 2024 diff hist +49‎ Pulay stress ‎No edit summary
• 13:0713:07, 31 July 2024 diff hist +17‎ Construction:VASP from Gaussian type orbitals ‎ →‎Introduction
• 13:0413:04, 31 July 2024 diff hist −15‎ Construction:VASP from Gaussian type orbitals ‎ →‎Introduction
• 13:0113:01, 31 July 2024 diff hist +194‎ Pulay stress ‎No edit summary
• 12:5512:55, 31 July 2024 diff hist 0‎ Construction:VASP from Gaussian type orbitals ‎ →‎Introduction
• 12:5312:53, 31 July 2024 diff hist +69‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 12:4212:42, 31 July 2024 diff hist +7‎ Construction:VASP from Gaussian type orbitals ‎ →‎Introduction
• 12:4012:40, 31 July 2024 diff hist −15‎ Construction:VASP from Gaussian type orbitals ‎ →‎Introduction
• 12:3812:38, 31 July 2024 diff hist +26‎ Construction:VASP from Gaussian type orbitals ‎ →‎Introduction
• 12:3312:33, 31 July 2024 diff hist +2‎ Construction:VASP from Gaussian type orbitals ‎ →‎Introduction
• 12:3112:31, 31 July 2024 diff hist +15‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 12:3012:30, 31 July 2024 diff hist +28‎ Construction:VASP from Gaussian type orbitals ‎ →‎Introduction
• 12:2812:28, 31 July 2024 diff hist −137‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 12:2312:23, 31 July 2024 diff hist +3‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 12:2012:20, 31 July 2024 diff hist 0‎ File:Shape pulay grids.png ‎ Csheldon uploaded a new version of File:Shape pulay grids.png current
• 12:2012:20, 31 July 2024 diff hist 0‎ File:Pulay stress grids.png ‎ Csheldon uploaded a new version of File:Pulay stress grids.png current
• 11:5911:59, 31 July 2024 diff hist −10‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 11:5411:54, 31 July 2024 diff hist +178‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 11:4811:48, 31 July 2024 diff hist −33‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 11:4411:44, 31 July 2024 diff hist −226‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 11:4011:40, 31 July 2024 diff hist 0‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 11:3911:39, 31 July 2024 diff hist 0‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 11:3711:37, 31 July 2024 diff hist −122‎ Construction:VASP from Gaussian type orbitals ‎No edit summary
• 11:3111:31, 31 July 2024 diff hist 0‎ m LCALCEPS ‎ Incorrect Born effective charge tensor indices current
• 11:2911:29, 31 July 2024 diff hist −1‎ Construction:VASP from Gaussian type orbitals ‎ →‎Introduction
• 11:2511:25, 31 July 2024 diff hist +158‎ Template:Cite ‎No edit summary
• 11:2211:22, 31 July 2024 diff hist −4‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 11:2011:20, 31 July 2024 diff hist +25‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:3010:30, 31 July 2024 diff hist +2‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:1810:18, 31 July 2024 diff hist 0‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:1710:17, 31 July 2024 diff hist −1‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:1710:17, 31 July 2024 diff hist +1‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:1710:17, 31 July 2024 diff hist 0‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:1610:16, 31 July 2024 diff hist 0‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:1610:16, 31 July 2024 diff hist −1‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:1210:12, 31 July 2024 diff hist +3‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:1210:12, 31 July 2024 diff hist −8‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:1110:11, 31 July 2024 diff hist +118‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 10:0910:09, 31 July 2024 diff hist +54‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 09:5409:54, 31 July 2024 diff hist −55‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating
• 09:4009:40, 31 July 2024 diff hist +8‎ Construction:VASP from Gaussian type orbitals ‎ →‎Calculating