User contributions for Ql2415
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17 March 2016
- 16:2316:23, 17 March 2016 diff hist 0 Rep:MOD:OOR10969 →10. Molecular Orbitals
- 16:2216:22, 17 March 2016 diff hist +73 Rep:MOD:OOR10969 →Project molecule--CLF
- 16:2116:21, 17 March 2016 diff hist 0 N File:3P-2p antibonding.png No edit summary current
- 16:0216:02, 17 March 2016 diff hist +37 Rep:MOD:OOR10969 →NH3 molecule
- 16:0116:01, 17 March 2016 diff hist +37 Rep:MOD:OOR10969 →N2 molecule
- 16:0016:00, 17 March 2016 diff hist +34 Rep:MOD:OOR10969 →H2 molecule
- 16:0016:00, 17 March 2016 diff hist −19 Rep:MOD:OOR10969 →2. Calculation Method& Basis set
- 15:5915:59, 17 March 2016 diff hist +56 Rep:MOD:OOR10969 →Project molecule--CLF
- 15:5615:56, 17 March 2016 diff hist +2 Rep:MOD:OOR10969 →8. IR Vibrations
- 15:5615:56, 17 March 2016 diff hist −36 Rep:MOD:OOR10969 →Project molecule Bond length
- 15:5515:55, 17 March 2016 diff hist +5 Rep:MOD:OOR10969 →Project molecule
- 15:5515:55, 17 March 2016 diff hist +3 Rep:MOD:OOR10969 →Jmol chlorine
- 15:5515:55, 17 March 2016 diff hist 0 Rep:MOD:OOR10969 →Jmol Of Florine
- 15:5515:55, 17 March 2016 diff hist −32 Rep:MOD:OOR10969 →Jmol of florine
- 15:5415:54, 17 March 2016 diff hist +9 Rep:MOD:OOR10969 →8. Jmol
- 15:5415:54, 17 March 2016 diff hist +26 Rep:MOD:OOR10969 →8. Jmol
- 15:5315:53, 17 March 2016 diff hist −2 Rep:MOD:OOR10969 →Jmol chlorine
- 15:5315:53, 17 March 2016 diff hist +27 Rep:MOD:OOR10969 →Jmol chlorine
- 15:5215:52, 17 March 2016 diff hist +543 Rep:MOD:OOR10969 No edit summary
- 15:5015:50, 17 March 2016 diff hist 0 N File:LQE CL2 OPTF POP.LOG No edit summary current
- 15:5015:50, 17 March 2016 diff hist 0 N File:LQE F2 OPTF POP.LOG No edit summary current
- 15:4915:49, 17 March 2016 diff hist +273 Rep:MOD:OOR10969 No edit summary
- 15:2115:21, 17 March 2016 diff hist +2 Rep:MOD:OOR10969 →6. Item
- 15:2115:21, 17 March 2016 diff hist +3 Rep:MOD:OOR10969 →6. Item
- 15:2115:21, 17 March 2016 diff hist +87 Rep:MOD:OOR10969 →8. IR Vibrations
- 15:2015:20, 17 March 2016 diff hist +7 Rep:MOD:OOR10969 →6. Item
- 15:1915:19, 17 March 2016 diff hist +150 Rep:MOD:OOR10969 →9. Charge
- 15:1315:13, 17 March 2016 diff hist −1 Rep:MOD:OOR10969 →9. Charge
- 15:1315:13, 17 March 2016 diff hist −27 Rep:MOD:OOR10969 →9. Charge
- 15:1215:12, 17 March 2016 diff hist +139 Rep:MOD:OOR10969 No edit summary
- 15:0915:09, 17 March 2016 diff hist +26 Rep:MOD:OOR10969 →7. Jmol
- 15:0815:08, 17 March 2016 diff hist +1 Rep:MOD:OOR10969 →7. Jmol
- 15:0815:08, 17 March 2016 diff hist −26 Rep:MOD:OOR10969 →7. Jmol
- 15:0715:07, 17 March 2016 diff hist 0 Rep:MOD:OOR10969 →7. Jmol
- 15:0715:07, 17 March 2016 diff hist −1 Rep:MOD:OOR10969 →7. Jmol
- 15:0615:06, 17 March 2016 diff hist 0 Rep:MOD:OOR10969 →8. IR Vibrations
- 15:0615:06, 17 March 2016 diff hist −3 Rep:MOD:OOR10969 →7. Jmol
- 15:0515:05, 17 March 2016 diff hist 0 N File:LQE CLF OPTF POP.LOG No edit summary current
- 15:0515:05, 17 March 2016 diff hist 0 N File:LQE CLF OPT.png No edit summary current
- 15:0515:05, 17 March 2016 diff hist +403 Rep:MOD:OOR10969 No edit summary
- 15:0315:03, 17 March 2016 diff hist 0 Rep:MOD:OOR10969 →1. ClF Bond Length/ Bond Angle/ Point Group
- 15:0215:02, 17 March 2016 diff hist +956 Rep:MOD:OOR10969 →6. Item
- 14:5814:58, 17 March 2016 diff hist −11 Rep:MOD:OOR10969 →1. ClF Bond Length/ Bond Angle/ Point Group
- 14:5614:56, 17 March 2016 diff hist +1 Rep:MOD:OOR10969 →5. RMS gradient
- 14:5514:55, 17 March 2016 diff hist +1 Rep:MOD:OOR10969 →4. final energy E(RB3LYP) in atomic units (au)
- 14:5414:54, 17 March 2016 diff hist +451 Rep:MOD:OOR10969 No edit summary
- 14:4714:47, 17 March 2016 diff hist −1 Rep:MOD:OOR10969 →8. Jmol
- 14:4614:46, 17 March 2016 diff hist 0 Rep:MOD:OOR10969 →8. Jmol
- 14:4514:45, 17 March 2016 diff hist −1 Rep:MOD:OOR10969 →8. Jmol
- 14:4314:43, 17 March 2016 diff hist 0 N File:LQE N2 OPTF POP.LOG No edit summary current