User contributions for Aab1817
Appearance
16 May 2019
- 14:5714:57, 16 May 2019 diff hist +8 CCL:01346889 →Creating a better basis set
- 14:5614:56, 16 May 2019 diff hist −11 CCL:01346889 →Frequency analysis of BH3
- 14:5114:51, 16 May 2019 diff hist +30 CCL:01346889 →Creating and optimising a BH3 molecule
- 14:4814:48, 16 May 2019 diff hist −15 CCL:01346889 →NH3BH3
- 14:4114:41, 16 May 2019 diff hist +5 CCL:01346889 →Determining the energy of the bond
- 14:4014:40, 16 May 2019 diff hist 0 File:Aab1817 add summary.PNG Aab1817 uploaded a new version of File:Aab1817 add summary.PNG current
- 14:3414:34, 16 May 2019 diff hist +14 CCL:01346889 →Determining the energy of the bond
- 14:2514:25, 16 May 2019 diff hist +20 CCL:01346889 →Ammonia Borane
- 14:2314:23, 16 May 2019 diff hist +109 CCL:01346889 →Determining the energy of the bond
- 14:2014:20, 16 May 2019 diff hist +123 CCL:01346889 →NH3BH3
- 14:1714:17, 16 May 2019 diff hist +28 N File:Aab1817 add summary.PNG Summary table of the adduct.
- 14:1714:17, 16 May 2019 diff hist +29 CCL:01346889 →NH3
- 14:1514:15, 16 May 2019 diff hist +85 CCL:01346889 →NH3
- 14:1414:14, 16 May 2019 diff hist +44 N File:Aab1817 nh3 opt summary.PNG Summary table for the optimised NH3 molecule current
- 14:1214:12, 16 May 2019 diff hist +603 CCL:01346889 →NH3BH3
- 14:0614:06, 16 May 2019 diff hist +691 CCL:01346889 →NH3
- 13:4413:44, 16 May 2019 diff hist +913 CCL:01346889 →Molecular Orbitals of BH3
- 13:3813:38, 16 May 2019 diff hist +57 N File:Aab1817 mo bh3.png MO diagram for BH3 including pictures of the computed MOs current
- 13:3713:37, 16 May 2019 diff hist +254 CCL:01346889 →Molecular Orbitals of BH3
- 12:0912:09, 16 May 2019 diff hist +44 CCL:01346889 →Revision
- 12:0312:03, 16 May 2019 diff hist +126 CCL:01346889 →Ammonia Borane
- 11:5911:59, 16 May 2019 diff hist +268 CCL:01346889 →Ammonia Borane
- 11:5811:58, 16 May 2019 diff hist +17 CCL:01346889 →Ammonia Borane
- 11:5611:56, 16 May 2019 diff hist +53 CCL:01346889 →Ammonia Borane
- 11:5211:52, 16 May 2019 diff hist +22 CCL:01346889 →Revision
- 11:5011:50, 16 May 2019 diff hist +1 CCL:01346889 →Frequency analysis of BH3
- 11:5011:50, 16 May 2019 diff hist +19 CCL:01346889 →Creating a better basis set
- 11:4911:49, 16 May 2019 diff hist +1 CCL:01346889 →Frequency analysis of BH3
- 11:4911:49, 16 May 2019 diff hist +24 CCL:01346889 →Frequency analysis of BH3
- 11:4811:48, 16 May 2019 diff hist +261 CCL:01346889 →Frequency analysis of BH3
- 11:4711:47, 16 May 2019 diff hist 0 File:Aab1817 BH3 FREQ.LOG Aab1817 uploaded a new version of File:Aab1817 BH3 FREQ.LOG current
- 11:4611:46, 16 May 2019 diff hist +6 CCL:01346889 →Creating and optimising a BH3 molecule
- 11:4411:44, 16 May 2019 diff hist +11 CCL:01346889 →Creating a better basis set
- 11:4411:44, 16 May 2019 diff hist +3 CCL:01346889 →Creating a better basis set
- 11:4311:43, 16 May 2019 diff hist +78 N File:Aab1817 imp bh3 summary.PNG Summary table for the second optimisation for BH3 using an improved basis set. current
- 11:4011:40, 16 May 2019 diff hist +724 CCL:01346889 →Creating a better basis set
- 11:3911:39, 16 May 2019 diff hist 0 File:Aab1817 opt bh3 summary.PNG Aab1817 uploaded a new version of File:Aab1817 opt bh3 summary.PNG current
- 11:3711:37, 16 May 2019 diff hist +69 N File:Aab1817 BH3 IMP SET.LOG Log file for the optimisation for BH3 ran with an improved basis set. current
- 11:3611:36, 16 May 2019 diff hist −54 CCL:01346889 →Creating and optimising a BH3 molecule
- 11:3511:35, 16 May 2019 diff hist +90 CCL:01346889 →Creating and optimising a BH3 molecule
- 11:3411:34, 16 May 2019 diff hist 0 File:Aab1817 opt bh3 summary.PNG Aab1817 uploaded a new version of File:Aab1817 opt bh3 summary.PNG
- 11:3211:32, 16 May 2019 diff hist +394 CCL:01346889 →Creating and optimising a BH3 molecule
- 11:3011:30, 16 May 2019 diff hist 0 CCL:01346889 →Creating and optimising a BH3 molecule
- 11:3011:30, 16 May 2019 diff hist +216 CCL:01346889 →Creating and optimising a BH3 molecule
- 11:2811:28, 16 May 2019 diff hist +54 N File:Aab1817 BH3 OPT.LOG log file of the first optimisation of the BH3 molecule current
14 May 2019
- 16:0016:00, 14 May 2019 diff hist +57 N File:Aab1817 BH3 FREQ.LOG Log file for the BH3 molecule used for frequency analysis
- 15:5515:55, 14 May 2019 diff hist −2 CCL:01346889 →Frequency analysis of BH3
- 15:5515:55, 14 May 2019 diff hist +296 CCL:01346889 →Frequency analysis of BH3
- 15:4315:43, 14 May 2019 diff hist +60 CCL:01346889 →Frequency analysis of BH3
- 15:4215:42, 14 May 2019 diff hist +62 CCL:01346889 →Creating a better basis set