User contributions for Phw417
Appearance
21 May 2019
- 13:5713:57, 21 May 2019 diff hist 0 N File:Phw417 rts+δ(mep,reversed,contour) Surface Plot.png No edit summary current
- 13:5613:56, 21 May 2019 diff hist 0 N File:Phw417 rts+δ(mep,reversed,distance) Surface Plot.png No edit summary current
- 13:5513:55, 21 May 2019 diff hist 0 File:Phw417 rts+δ(mep,reversed) Surface Plot.png Phw417 uploaded a new version of File:Phw417 rts+δ(mep,reversed) Surface Plot.png current
- 13:2813:28, 21 May 2019 diff hist 0 N File:Phw417 rts+δ(mep,reversed) Surface Plot.png No edit summary
- 13:1013:10, 21 May 2019 diff hist 0 N File:Phw417 rts+δ(mep) Surface Plot.png No edit summary current
- 13:0913:09, 21 May 2019 diff hist 0 N File:Phw417 rts+δ(dynamics) Surface Plot.png No edit summary current
- 12:5212:52, 21 May 2019 diff hist 0 File:Phw417 r1=r2 Surface Plot.png Phw417 uploaded a new version of File:Phw417 r1=r2 Surface Plot.png current
- 12:4912:49, 21 May 2019 diff hist 0 N File:Phw417 r1=r2 Surface Plot.png No edit summary
- 12:4712:47, 21 May 2019 diff hist +148 MRD:phw417 No edit summary Tag: Visual edit
- 12:3212:32, 21 May 2019 diff hist +741 N MRD:phw417 Created page with "== H + H<sub>2 </sub>system == On a potential energy surface diagram, the transition state is mathematically defined as the saddle point. The transition state has partial deri..." Tag: Visual edit
10 May 2019
- 15:4915:49, 10 May 2019 diff hist +8 Pakwiki →Optimisation
- 15:4915:49, 10 May 2019 diff hist +1 Pakwiki →Optimisation
- 15:4715:47, 10 May 2019 diff hist +7 Pakwiki →Analysis
- 15:4715:47, 10 May 2019 diff hist +7 Pakwiki →Analysis of a highly bonding MO
- 15:4615:46, 10 May 2019 diff hist −7 Pakwiki →Analysis of a highly bonding MO
- 15:3815:38, 10 May 2019 diff hist −3 Pakwiki →Analysis of a highly bonding MO
- 15:3815:38, 10 May 2019 diff hist 0 Pakwiki →Analysis of a highly antibonding MO
- 15:3815:38, 10 May 2019 diff hist 0 Pakwiki →Analysis of a weakly bonding MO
- 15:3715:37, 10 May 2019 diff hist 0 Pakwiki →Analysis of a highly bonding MO
- 15:3715:37, 10 May 2019 diff hist +4 Pakwiki →Analysis of a highly bonding MO
- 15:3715:37, 10 May 2019 diff hist +2 Pakwiki →Analysis of a highly antibonding MO
- 15:3715:37, 10 May 2019 diff hist +2 Pakwiki →Analysis of a weakly bonding MO
- 15:3615:36, 10 May 2019 diff hist +2 Pakwiki →Analysis of a highly bonding MO
- 15:3615:36, 10 May 2019 diff hist −182 Pakwiki →Analysis of a highly bonding MO
- 15:3615:36, 10 May 2019 diff hist +182 Pakwiki →MO analysis on the lowest energy isomer
- 15:3615:36, 10 May 2019 diff hist +7 Pakwiki →Analysis of a highly bonding MO
- 15:3515:35, 10 May 2019 diff hist −7 Pakwiki →Analysis of a highly bonding MO
- 15:3515:35, 10 May 2019 diff hist +270 Pakwiki →MO analysis on the lowest energy isomer
- 15:3115:31, 10 May 2019 diff hist 0 File:MO 40 annotated.png Phw417 uploaded a new version of File:MO 40 annotated.png current
- 15:2915:29, 10 May 2019 diff hist +136 Pakwiki →MO analysis on the lowest energy isomer
- 15:2715:27, 10 May 2019 diff hist +276 Pakwiki →MO analysis on the lowest energy isomer
- 15:2615:26, 10 May 2019 diff hist 0 N File:MO 43 annotated.png No edit summary current
- 15:2615:26, 10 May 2019 diff hist 0 N File:MO 41 annotated.png No edit summary current
- 15:2615:26, 10 May 2019 diff hist −19 Pakwiki →MO analysis on the lowest energy isomer
- 15:2515:25, 10 May 2019 diff hist 0 N File:MO 40 annotated.png No edit summary
- 15:2115:21, 10 May 2019 diff hist +117 Pakwiki →MO analysis on the lowest energy isomer
- 15:2015:20, 10 May 2019 diff hist +40 Pakwiki →MO analysis on the lowest energy isomer
- 15:1915:19, 10 May 2019 diff hist 0 N File:Lowest Energy Conformer Annotation.png No edit summary current
9 May 2019
- 18:1218:12, 9 May 2019 diff hist −2 Pakwiki →Optimisation
- 18:1118:11, 9 May 2019 diff hist −5 Pakwiki →Optimisation
- 18:0418:04, 9 May 2019 diff hist +10 Pakwiki →Optimisation
- 18:0318:03, 9 May 2019 diff hist 0 N File:Angus Al opt freq.gjf.log No edit summary current
- 18:0318:03, 9 May 2019 diff hist 0 Pakwiki →Frequency Analysis
- 17:5117:51, 9 May 2019 diff hist +32 Pakwiki →Dissociation Energy for lowest energy conformer to AlCl2Br
- 17:4717:47, 9 May 2019 diff hist +1 Pakwiki →Optimisation
- 17:4617:46, 9 May 2019 diff hist −6 Pakwiki →Summary
- 17:4617:46, 9 May 2019 diff hist −6 Pakwiki →Summary
- 17:4517:45, 9 May 2019 diff hist +319 Pakwiki →Analysis
- 17:4117:41, 9 May 2019 diff hist 0 Pakwiki →Energies of conformers
- 17:3917:39, 9 May 2019 diff hist −2 Pakwiki →Optimisation