User contributions for Sg2317
27 February 2018
- 10:4810:48, 27 February 2018 diff hist 0 N File:Simran nh3 vibrations.png No edit summary current
- 10:4710:47, 27 February 2018 diff hist 0 N File:SIMRAN N2 VIBRATIONS.PNG No edit summary current
- 10:4710:47, 27 February 2018 diff hist +743 Rep:Mod:01341438 →NH3 Molecule
- 10:2910:29, 27 February 2018 diff hist +1,590 Rep:Mod:01341438 →NH3 Molecule
- 10:2810:28, 27 February 2018 diff hist 0 N File:N2 VIBRATIONS.PNG No edit summary current
- 10:1810:18, 27 February 2018 diff hist 0 N File:SIMRAN N2 OPT.LOG No edit summary current
26 February 2018
- 22:2122:21, 26 February 2018 diff hist +2,682 Rep:Mod:01341438 →NH3 Molecule
- 21:5821:58, 26 February 2018 diff hist 0 File:Nh3 vibrations.PNG Sg2317 uploaded a new version of File:Nh3 vibrations.PNG
- 21:3621:36, 26 February 2018 diff hist 0 N File:SIMRAN NH3 OPT.log No edit summary current
- 21:3321:33, 26 February 2018 diff hist 0 N File:SIMRAN NH3 OPTIMISATION.log No edit summary current
- 21:1521:15, 26 February 2018 diff hist 0 N File:Nh3 image.png No edit summary current
- 11:4911:49, 26 February 2018 diff hist +206 N Rep:Mod:01341438 Created page with "==NH3 Molecule== ===Calculation Method=== RB3LYP ===Basis Method=== 6-31G(d.p) ===Final energy E(RB3LYP)=== -56.44397188 a.u. ===RMS gradient=== 0.00000485a.u. ===Point group..."
