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User contributions for Dk2710

Results for Dk2710 talk block log uploads logs

A user with 521 edits. Account created on 12 November 2012.

17:5717:57, 28 November 2012 diff hist 0 N File:HexadieneGauche3Opt3.jpg No edit summary
17:5717:57, 28 November 2012 diff hist 0 N File:HEXADIENEGAUCHE3OPT3.LOG No edit summary
17:2517:25, 28 November 2012 diff hist 0 File:HexadieneAPPOpt.LOG uploaded a new version of "File:HexadieneAPPOpt.LOG"
17:2517:25, 28 November 2012 diff hist 0 File:HexadieneAPPOpt.jpg uploaded a new version of "File:HexadieneAPPOpt.jpg"
17:1417:14, 28 November 2012 diff hist 0 N File:HexadieneAPPOpt.jpg No edit summary
17:1417:14, 28 November 2012 diff hist −55 Rep:Mod:dk27102 →Hexadiene=
17:1017:10, 28 November 2012 diff hist 0 N File:HexadieneAPPOpt.LOG No edit summary

12:4512:45, 26 November 2012 diff hist +858 N Rep:Mod:dk27102 Created page with "===Hexadiene==== Opt: {| class="wikitable" border="1" |+ Method | '''Method''' || Ground State || DFT || Default Spin || B3LYP |- | '''Basis Set''' || 3-21G |- | '''Charge''' |..."

14:2514:25, 23 November 2012 diff hist +310 Rep:Mod:dk2710 →Comparison of Energies of NH3, BH3, NH3BH3
14:1414:14, 23 November 2012 diff hist +427 Rep:Mod:dk2710 →Molecular Orbitals of BH3
00:3100:31, 23 November 2012 diff hist +407 Rep:Mod:dk2710 →Aromaticity
00:2400:24, 23 November 2012 diff hist +180 Rep:Mod:dk2710 →Errors in Calculations
00:2000:20, 23 November 2012 diff hist 0 Rep:Mod:dk2710 →3-21G Basis Set
00:2000:20, 23 November 2012 diff hist −5 Rep:Mod:dk2710 →6-31G Basis Set
00:2000:20, 23 November 2012 diff hist 0 Rep:Mod:dk2710 →Optimisation of TlBr3
00:1900:19, 23 November 2012 diff hist 0 Rep:Mod:dk2710 →Optimisation of BBr3
00:1900:19, 23 November 2012 diff hist +1 Rep:Mod:dk2710 →Frequency Analysis of BH3
00:1900:19, 23 November 2012 diff hist −3 Rep:Mod:dk2710 →Comparison of BH3, TlBr3, BBr3
00:1800:18, 23 November 2012 diff hist −43 Rep:Mod:dk2710 →Frequency Analysis of BH3
00:1600:16, 23 November 2012 diff hist 0 Rep:Mod:dk2710 →Vibrational Comparison of BH3 and TlBr3
00:1600:16, 23 November 2012 diff hist −43 Rep:Mod:dk2710 →Frequency Analysis of TlBr3
00:1400:14, 23 November 2012 diff hist −96 Rep:Mod:dk2710 →Vibrational Comparison of BH3 and TlBr3
00:1100:11, 23 November 2012 diff hist −21 Rep:Mod:dk2710 →Molecular Orbitals of BH3
00:1000:10, 23 November 2012 diff hist −6 Rep:Mod:dk2710 →NH3 analysis
00:0900:09, 23 November 2012 diff hist −8 Rep:Mod:dk2710 →NH3 Vibrational analysis
00:0900:09, 23 November 2012 diff hist −30 Rep:Mod:dk2710 →NH3 Vibrational analysis
00:0800:08, 23 November 2012 diff hist −5 Rep:Mod:dk2710 →NH3 MO Analysis
00:0700:07, 23 November 2012 diff hist −21 Rep:Mod:dk2710 →NH3 MO Analysis
00:0700:07, 23 November 2012 diff hist −2 Rep:Mod:dk2710 →Optimisation and Frequency Analysis
00:0600:06, 23 November 2012 diff hist +57 Rep:Mod:dk2710 →Comparison of Energies of NH3, BH3, NH3BH3
00:0500:05, 23 November 2012 diff hist −2 Rep:Mod:dk2710 →Optimisation and Frequency Analysis
00:0300:03, 23 November 2012 diff hist −3 Rep:Mod:dk2710 →Optimisation and Frequency Analysis
00:0200:02, 23 November 2012 diff hist −2 Rep:Mod:dk2710 →Optimisation and Frequency Analysis
00:0200:02, 23 November 2012 diff hist −18 Rep:Mod:dk2710 →Comparison of Energies of NH3, BH3, NH3BH3
00:0100:01, 23 November 2012 diff hist −2 Rep:Mod:dk2710 →Optimisation and Frequency Analysis

23:5723:57, 22 November 2012 diff hist +135 Rep:Mod:dk2710 →NBO Analysis of Benzene, Boratabenzene, Pyridinium and Borazine
23:5723:57, 22 November 2012 diff hist +3 Rep:Mod:dk2710 →NBO Analysis of Benzene, Boratabenzene, Pyridinium and Borazine
23:5723:57, 22 November 2012 diff hist +92 Rep:Mod:dk2710 →NBO Analysis of Benzene, Boratabenzene, Pyridinium and Borazine
23:5323:53, 22 November 2012 diff hist +642 Rep:Mod:dk2710 →NBO Analysis of Benzene, Boratabenzene, Pyridinium and Borazine
23:4223:42, 22 November 2012 diff hist +200 Rep:Mod:dk2710 →NBO Analysis of Benzene, Boratabenzene, Pyridinium and Borazine
23:3423:34, 22 November 2012 diff hist +58 Rep:Mod:dk2710 →NBO Analysis of Benzene, Boratabenzene, Pyridinium and Borazine
23:3023:30, 22 November 2012 diff hist +43 Rep:Mod:dk2710 →Natural Population Analysis of Benzene, Boratabenzene, Pyridinium and Borazine
23:2823:28, 22 November 2012 diff hist +19 Rep:Mod:dk2710 →NBO Analysis of Benzene, Boratabenzene, Pyridinium and Borazine
23:2023:20, 22 November 2012 diff hist −5 Rep:Mod:dk2710 →MO Analysis
23:2023:20, 22 November 2012 diff hist 0 N File:BZMO.jpg No edit summary current
22:5022:50, 22 November 2012 diff hist −16 Rep:Mod:dk2710 →6-31G Basis Set
22:4922:49, 22 November 2012 diff hist +16 Rep:Mod:dk2710 →NBO Analysis of Benzene, Boratabenzene, Pyridinium and Borazine
22:4922:49, 22 November 2012 diff hist −15 Rep:Mod:dk2710 →Comparison of Energies of NH3, BH3, NH3BH3
22:4922:49, 22 November 2012 diff hist +412 Rep:Mod:dk2710 →Comparison of Energies of NH3, BH3, NH3BH3
22:3622:36, 22 November 2012 diff hist −30 Rep:Mod:dk2710 →Comparison of Energies of NH3, BH3, NH3BH3

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