User contributions for Gj2118

29 March 2019

• 16:4116:41, 29 March 2019 diff hist +87 Rep:Mod:GJ2118mm2 No edit summary
• 16:2216:22, 29 March 2019 diff hist 0 N File:AMMONIA-OPTIMISATION.chk No edit summary current
• 16:1716:17, 29 March 2019 diff hist 0 N File:Gj2118+methane.gjf No edit summary current
• 16:1616:16, 29 March 2019 diff hist 0 File:NITROGEN OPTIMISATION.chk Gj2118 uploaded a new version of File:NITROGEN OPTIMISATION.chk current
• 16:1416:14, 29 March 2019 diff hist +175 Rep:Mod:GJ2118mm2 No edit summary
• 16:1216:12, 29 March 2019 diff hist +370 Rep:Mod:GJ2118mm2 No edit summary
• 16:1016:10, 29 March 2019 diff hist +187 Rep:Mod:GJ2118mm2 No edit summary
• 16:0816:08, 29 March 2019 diff hist 0 N File:NITROGEN OPTIMISATION.chk No edit summary
• 16:0416:04, 29 March 2019 diff hist 0 N File:HYDROGEN OPTIMISATION.gjf No edit summary current
• 15:4315:43, 29 March 2019 diff hist +48 Rep:Mod:GJ2118mm2 No edit summary
• 15:3515:35, 29 March 2019 diff hist +2,877 Rep:Mod:GJ2118mm2 No edit summary

27 March 2019

• 18:5518:55, 27 March 2019 diff hist +378 Rep:Mod:GJ2118mm2 No edit summary
• 17:4817:48, 27 March 2019 diff hist +24 Rep:Mod:GJ2118mm2 No edit summary
• 17:0817:08, 27 March 2019 diff hist −41 Rep:Mod:GJ2118mm2 No edit summary
• 16:4716:47, 27 March 2019 diff hist 0 N File:JAMONTOAST.LOG No edit summary current
• 16:0416:04, 27 March 2019 diff hist 0 File:Gj2118nh3.log Gj2118 uploaded a new version of File:Gj2118nh3.log current
• 16:0216:02, 27 March 2019 diff hist 0 N File:GJ2118 nh3 optimisation pop.gjf No edit summary current
• 15:5015:50, 27 March 2019 diff hist 0 N File:Gj2118nh3.log No edit summary

26 March 2019

• 17:2117:21, 26 March 2019 diff hist +190 Rep:Mod:GJ2118mm2 No edit summary
• 16:5416:54, 26 March 2019 diff hist +545 N Rep:Mod:GJ2118mm2 Created page with "== NH3 Molecule == === NH3 Optimisation Results === molecule name: Ammonia calculation method: RB3LYP basis set: 6-31G(d,p) final energy E(RB3LYP) : -56.55776861 the poin..."