User contributions for Vc2217

19 March 2018

• 11:4411:44, 19 March 2018 diff hist +949 Rep:Mod:VC2217 No edit summary
• 11:1811:18, 19 March 2018 diff hist 0 File:NH3 VIBRATIONS.png Vc2217 uploaded a new version of File:NH3 VIBRATIONS.png
• 11:1611:16, 19 March 2018 diff hist 0 N File:NH3 VIBRATIONS.png No edit summary
• 10:5410:54, 19 March 2018 diff hist +351 Rep:Mod:VC2217 →NH3 Optimization
• 10:3210:32, 19 March 2018 diff hist +1,496 N Rep:Mod:VC2217 Created page with " == NH3 Optimization == Calculation method: RB3LYP Basis set:6-31G(d,p) Final energy E(RB3LYP) in atomic units (au): -56.5577 RMS gradient: 0.00000485 Point group of m..."
• 09:4909:49, 19 March 2018 diff hist 0 N File:VIRGINIA NH3 OPTIMIZATION.LOG No edit summary current