User contributions for Hs5017
Appearance
15 May 2019
- 15:3015:30, 15 May 2019 diff hist 0 N File:HS Ncomplex charge.PNG No edit summary current
- 15:2915:29, 15 May 2019 diff hist +1,904 InorganicGaussian 01327311 No edit summary
- 15:0815:08, 15 May 2019 diff hist +966 InorganicGaussian 01327311 →NH3BH3
- 15:0115:01, 15 May 2019 diff hist +1,436 InorganicGaussian 01327311 →MO DIAGRAM OF BH3
- 14:5914:59, 15 May 2019 diff hist −1,482 InorganicGaussian 01327311 →Comparison of MO diagrams: Gaussian vs LCAO
- 14:5814:58, 15 May 2019 diff hist −134 InorganicGaussian 01327311 →Comparison of MO diagrams: Gaussian vs LCAO
- 14:5414:54, 15 May 2019 diff hist +1,641 InorganicGaussian 01327311 →BH3 Molecule
- 14:2514:25, 15 May 2019 diff hist −5 InorganicGaussian 01327311 No edit summary
- 14:2414:24, 15 May 2019 diff hist −5 InorganicGaussian 01327311 →BH3 Molecule
- 14:2314:23, 15 May 2019 diff hist +2 InorganicGaussian 01327311 →[P(CH3)4]+
- 14:2214:22, 15 May 2019 diff hist +3,296 InorganicGaussian 01327311 No edit summary
- 14:0114:01, 15 May 2019 diff hist 0 InorganicGaussian 01327311 →BH3 Molecule
- 14:0014:00, 15 May 2019 diff hist +1 InorganicGaussian 01327311 →BH3 Molecule
- 14:0014:00, 15 May 2019 diff hist +18 InorganicGaussian 01327311 →BH3 Molecule
- 13:5713:57, 15 May 2019 diff hist +128 InorganicGaussian 01327311 No edit summary
- 13:5513:55, 15 May 2019 diff hist +504 InorganicGaussian 01327311 No edit summary
- 13:5313:53, 15 May 2019 diff hist 0 N File:HS BH3 summary.PNG No edit summary
14 May 2019
- 17:0217:02, 14 May 2019 diff hist 0 InorganicGaussian 01327311 No edit summary
- 17:0217:02, 14 May 2019 diff hist 0 File:HARUKA BH3 FREQ 631G DP EDITED.LOG Hs5017 uploaded a new version of File:HARUKA BH3 FREQ 631G DP EDITED.LOG current
- 17:0117:01, 14 May 2019 diff hist +194 N InorganicGaussian 01327311 Created page with "<jmol><jmolApplet> <title>test molecule</title> <color>black</color> <size>200</size> <uploadedFileContents>HARUKA_BH3_FREQ_631G_DP_EDITED.log</uploadedFileContents> <..."
- 16:5716:57, 14 May 2019 diff hist 0 N File:HS PTD 631G FREQ OPT tight.gjf No edit summary current
- 16:5616:56, 14 May 2019 diff hist 0 File:HS PTD 6-31G FREQ OPT TIGHT.LOG Hs5017 uploaded a new version of File:HS PTD 6-31G FREQ OPT TIGHT.LOG current
- 16:5516:55, 14 May 2019 diff hist 0 N File:HS PTD 6-31G FREQ OPT TIGHT.LOG No edit summary
- 16:5516:55, 14 May 2019 diff hist 0 N File:HS NI3 OPT REDO FREQ.LOG No edit summary
- 16:5416:54, 14 May 2019 diff hist 0 N File:HS NH3 FREQOPT.LOG No edit summary current
- 16:5416:54, 14 May 2019 diff hist 0 N File:HS NTD FREQOPT MO.LOG No edit summary current
- 16:5416:54, 14 May 2019 diff hist 0 N File:HARUKA BH3 FREQ 631G DP EDITED.LOG No edit summary
3 May 2019
- 17:0117:01, 3 May 2019 diff hist +7 MRD:01327311 →EXERCISE 2: F - H - H system
- 17:0117:01, 3 May 2019 diff hist −456 MRD:01327311 →Determining reaction profile from surface plot
- 17:0017:00, 3 May 2019 diff hist +398 MRD:01327311 →PES Inspection
- 16:5916:59, 3 May 2019 diff hist 0 N File:SurfaceHF.PNG No edit summary current
- 16:5616:56, 3 May 2019 diff hist −14 MRD:01327311 →Determining reaction profile from surface plot
- 16:5516:55, 3 May 2019 diff hist +14 MRD:01327311 →Determining reaction profile from surface plot
- 16:5316:53, 3 May 2019 diff hist +153 MRD:01327311 →References
- 16:5216:52, 3 May 2019 diff hist +11 MRD:01327311 →Relating the transition state with a potential energy surface
- 16:5116:51, 3 May 2019 diff hist +112 MRD:01327311 →References
- 16:5016:50, 3 May 2019 diff hist +3 MRD:01327311 →Transition State Theory
- 16:5016:50, 3 May 2019 diff hist −77 MRD:01327311 →Transition State Theory
- 16:4716:47, 3 May 2019 diff hist +17 MRD:01327311 →Polanyi's theory
- 16:4716:47, 3 May 2019 diff hist −48 MRD:01327311 →Locating the transition state
- 16:4516:45, 3 May 2019 diff hist +524 MRD:01327311 →Polanyi's theory
- 16:4116:41, 3 May 2019 diff hist 0 N File:Contour polanyi.PNG No edit summary current
- 16:3416:34, 3 May 2019 diff hist +2,545 MRD:01327311 →Reaction Dynamics
- 16:3316:33, 3 May 2019 diff hist 0 N File:Highvib contour.png No edit summary current
- 16:3216:32, 3 May 2019 diff hist 0 N File:Hightrans contour.png No edit summary current
- 15:5315:53, 3 May 2019 diff hist +105 MRD:01327311 →EXERCISE 2: F - H - H system
- 15:1715:17, 3 May 2019 diff hist +26 MRD:01327311 →References
- 15:1615:16, 3 May 2019 diff hist −26 MRD:01327311 →References
- 15:1615:16, 3 May 2019 diff hist +82 MRD:01327311 No edit summary
- 15:1415:14, 3 May 2019 diff hist −7 MRD:01327311 →Locating the transition state