User contributions for Ms7215
Appearance
1 May 2018
- 14:4614:46, 1 May 2018 diff hist +1 Rep:Mod:MaxSLab →BH3 Pre-optimisation 'Item' Section
- 14:4614:46, 1 May 2018 diff hist +430 Rep:Mod:MaxSLab No edit summary
- 13:3513:35, 1 May 2018 diff hist +69 N Rep:Mod:MaxSLab Created page with "==Second Year Comp Lab== ===EX<sub>3</sub>=== ===Project Section==="
17 March 2017
- 12:3312:33, 17 March 2017 diff hist +195 IMM2 MS No edit summary current
- 12:3112:31, 17 March 2017 diff hist +234 IMM2 MS →Molecule of Choice - Cyanide CN-
- 11:4911:49, 17 March 2017 diff hist +562 IMM2 MS →Molecular Orbitals
- 11:3711:37, 17 March 2017 diff hist +1,362 IMM2 MS →Molecular Orbitals
- 11:2011:20, 17 March 2017 diff hist +353 IMM2 MS →Molecular Orbitals
- 11:1411:14, 17 March 2017 diff hist +70 IMM2 MS →Molecular Orbitals
- 11:1111:11, 17 March 2017 diff hist +407 IMM2 MS →Ammonia - NH3
- 11:0511:05, 17 March 2017 diff hist 0 N File:MStocker CN MOs.PNG No edit summary current
- 10:5810:58, 17 March 2017 diff hist 0 N File:MStocker CN MO 7+10.png No edit summary current
- 10:5810:58, 17 March 2017 diff hist 0 N File:MStocker CN MO 6+9.png No edit summary current
- 10:5810:58, 17 March 2017 diff hist 0 N File:MStocker CN MO 5+8.png No edit summary current
- 10:5810:58, 17 March 2017 diff hist 0 N File:MStocker CN MO 3+4.png No edit summary current
- 10:1610:16, 17 March 2017 diff hist 0 N File:MStocker cn charge.PNG No edit summary current
- 10:0910:09, 17 March 2017 diff hist +291 IMM2 MS →Molecule of Choice - Cyanide CN-
- 09:5809:58, 17 March 2017 diff hist +335 IMM2 MS →Molecule of Choice - Cyanide CN-
- 09:5609:56, 17 March 2017 diff hist 0 N File:MStocker cn freq.PNG No edit summary current
- 09:5009:50, 17 March 2017 diff hist −1 IMM2 MS →Molecule of Choice - Cyanide CN-
- 09:4909:49, 17 March 2017 diff hist 0 IMM2 MS No edit summary
- 09:4709:47, 17 March 2017 diff hist +219 IMM2 MS No edit summary
- 09:4609:46, 17 March 2017 diff hist 0 N File:MSTOCKER CN- OPTIFREQ POP.LOG No edit summary current
- 09:4509:45, 17 March 2017 diff hist 0 IMM2 MS →Molecule of Choice - Fluorine F2
- 09:4409:44, 17 March 2017 diff hist +1,400 IMM2 MS No edit summary
- 09:1109:11, 17 March 2017 diff hist +33 IMM2 MS →Charge Distribution
- 09:1109:11, 17 March 2017 diff hist 0 N File:MStocker nh3 charge.PNG No edit summary current
16 March 2017
- 11:5311:53, 16 March 2017 diff hist +319 IMM2 MS No edit summary
- 11:3811:38, 16 March 2017 diff hist −14 IMM2 MS No edit summary
- 11:2211:22, 16 March 2017 diff hist +15 IMM2 MS No edit summary
- 11:2111:21, 16 March 2017 diff hist +75 IMM2 MS No edit summary
- 11:1911:19, 16 March 2017 diff hist 0 IMM2 MS No edit summary
- 11:1811:18, 16 March 2017 diff hist +64 IMM2 MS No edit summary
- 10:5210:52, 16 March 2017 diff hist +493 IMM2 MS No edit summary
- 10:2910:29, 16 March 2017 diff hist +113 IMM2 MS No edit summary
- 10:2810:28, 16 March 2017 diff hist 0 N File:MStocker h2 freq.PNG No edit summary current
- 10:2010:20, 16 March 2017 diff hist 0 IMM2 MS No edit summary
- 10:2010:20, 16 March 2017 diff hist +1,641 IMM2 MS No edit summary
- 10:1910:19, 16 March 2017 diff hist 0 N File:MSTOCKER H2 OPTIFREQ POP.LOG No edit summary current
- 09:5909:59, 16 March 2017 diff hist +439 IMM2 MS No edit summary
- 09:5409:54, 16 March 2017 diff hist 0 N File:Mstocker n2 frew.PNG No edit summary current
- 09:3509:35, 16 March 2017 diff hist 0 N File:MSTOCKER-N2 OPTIFREQ POP2.LOG No edit summary current
- 09:3209:32, 16 March 2017 diff hist +1,387 IMM2 MS No edit summary
13 March 2017
- 11:5111:51, 13 March 2017 diff hist +4 IMM2 MS →Molecules
- 11:4811:48, 13 March 2017 diff hist +3 IMM2 MS →Charge Distribution
- 11:4811:48, 13 March 2017 diff hist +945 IMM2 MS →Molecules
- 11:1711:17, 13 March 2017 diff hist 0 N File:MStocker nh3 freq.PNG No edit summary current
- 11:0911:09, 13 March 2017 diff hist +293 IMM2 MS →Molecules
- 10:5710:57, 13 March 2017 diff hist 0 N File:MSTOCKER NH3 OPTIFREQ POP.LOG No edit summary current
- 10:4610:46, 13 March 2017 diff hist +1,922 N IMM2 MS Created page with "==Molecules== <b><u>NH<sub>3</sub></u></b> {| class="wikitable" border="1" |+ NH<sub>3</sub> ! Optimisation Data !! Value |- | Calculation Method || RB3LYP |- | Basis Set ||..."