User contributions for Rkf16
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16 March 2017
- 11:1311:13, 16 March 2017 diff hist 0 N File:Rkf BH4 orbital 6.PNG No edit summary current
- 11:1111:11, 16 March 2017 diff hist 0 N File:Rkf BH4 orbital 3.PNG No edit summary current
- 11:1011:10, 16 March 2017 diff hist 0 N File:Rkf BH4 orbital 2.PNG No edit summary current
- 11:0911:09, 16 March 2017 diff hist +474 Rep:Mod:qwe107 No edit summary
- 11:0911:09, 16 March 2017 diff hist 0 N File:Rkf BH4 orbital 1.PNG No edit summary current
- 10:5710:57, 16 March 2017 diff hist −29 Rep:Mod:qwe107 No edit summary
- 10:5710:57, 16 March 2017 diff hist +29 Rep:Mod:qwe107 No edit summary
- 10:5610:56, 16 March 2017 diff hist −1 Rep:Mod:qwe107 No edit summary
- 10:5110:51, 16 March 2017 diff hist −1 Rep:Mod:qwe107 →NH3
- 10:5010:50, 16 March 2017 diff hist +21 Rep:Mod:qwe107 No edit summary
- 10:4910:49, 16 March 2017 diff hist +35 Rep:Mod:qwe107 No edit summary
- 10:4610:46, 16 March 2017 diff hist −39 Rep:Mod:qwe107 No edit summary
- 10:4410:44, 16 March 2017 diff hist +322 Rep:Mod:qwe107 No edit summary
- 10:3010:30, 16 March 2017 diff hist −6 Rep:Mod:qwe107 No edit summary
- 10:3010:30, 16 March 2017 diff hist +6 Rep:Mod:qwe107 No edit summary
- 10:2910:29, 16 March 2017 diff hist 0 N File:Rkf16 BH4 display vibrations.PNG No edit summary current
- 10:2910:29, 16 March 2017 diff hist +921 Rep:Mod:qwe107 No edit summary
- 10:2710:27, 16 March 2017 diff hist 0 N File:RKF16 BH4- OPTIMISATION.LOG No edit summary current
- 10:1910:19, 16 March 2017 diff hist +30 Rep:Mod:qwe107 No edit summary
- 10:1510:15, 16 March 2017 diff hist +4 Rep:Mod:qwe107 →NH3 Optimisation
- 10:1510:15, 16 March 2017 diff hist +1 Rep:Mod:qwe107 →NH3 Optimisation
- 10:1410:14, 16 March 2017 diff hist −1 Rep:Mod:qwe107 →NH3 Optimisation
- 10:0910:09, 16 March 2017 diff hist −1 Rep:Mod:qwe107 No edit summary
- 10:0810:08, 16 March 2017 diff hist +1 Rep:Mod:qwe107 No edit summary
- 10:0110:01, 16 March 2017 diff hist +136 Rep:Mod:qwe107 No edit summary
- 09:5409:54, 16 March 2017 diff hist +11 Rep:Mod:qwe107 No edit summary
- 09:4709:47, 16 March 2017 diff hist +67 Rep:Mod:qwe107 No edit summary
- 09:2109:21, 16 March 2017 diff hist +170 Rep:Mod:qwe107 No edit summary
- 09:1509:15, 16 March 2017 diff hist −2 Rep:Mod:qwe107 No edit summary
- 09:1409:14, 16 March 2017 diff hist 0 N File:Rkf16 H2 display vibrations.PNG No edit summary current
- 09:1109:11, 16 March 2017 diff hist +845 Rep:Mod:qwe107 No edit summary
- 09:1009:10, 16 March 2017 diff hist 0 N File:RKF16 H2 OPTIMISATION POP.LOG No edit summary current
13 March 2017
- 12:0312:03, 13 March 2017 diff hist 0 N File:Rkf16 N2 display vibrations.PNGG No edit summary current
- 12:0212:02, 13 March 2017 diff hist −1 Rep:Mod:qwe107 No edit summary
- 12:0212:02, 13 March 2017 diff hist 0 File:Rkf16 N2 display vibrations.PNG Rkf16 uploaded a new version of File:Rkf16 N2 display vibrations.PNG current
- 11:5911:59, 13 March 2017 diff hist +44 Rep:Mod:qwe107 No edit summary
- 11:5811:58, 13 March 2017 diff hist 0 N File:Rkf16 N2 display vibrations.PNG No edit summary
- 11:5511:55, 13 March 2017 diff hist +30 Rep:Mod:qwe107 No edit summary
- 11:5411:54, 13 March 2017 diff hist +262 Rep:Mod:qwe107 No edit summary
- 11:5311:53, 13 March 2017 diff hist 0 N File:RKF16 N2 OPTIMISATION POP.LOG No edit summary current
- 11:5011:50, 13 March 2017 diff hist +732 Rep:Mod:qwe107 No edit summary
- 11:3511:35, 13 March 2017 diff hist +298 Rep:Mod:qwe107 No edit summary
- 11:2511:25, 13 March 2017 diff hist 0 N File:Rkf16 NH3 display vibrations.PNG No edit summary current
- 11:2311:23, 13 March 2017 diff hist 0 N File:Rkf16 NH3 display vibrations.JPG No edit summary current
- 11:1211:12, 13 March 2017 diff hist +78 Rep:Mod:qwe107 →NH3 Optimisation
- 11:0711:07, 13 March 2017 diff hist +30 Rep:Mod:qwe107 No edit summary
- 11:0611:06, 13 March 2017 diff hist −10 Rep:Mod:qwe107 No edit summary
- 11:0211:02, 13 March 2017 diff hist +105 Rep:Mod:qwe107 No edit summary
- 11:0011:00, 13 March 2017 diff hist 0 N File:RFARNDALE NH3 OPTF POP.LOG No edit summary current
- 10:4810:48, 13 March 2017 diff hist +626 N Rep:Mod:qwe107 Created page with "==NH3 Optimisation== What is the molecule? NH3 What is the calculation method? RB3LYP What is the basis set? 6-31G(d.p) What is the final energy E(RB3LYP) in atomic units (au)..."