User contributions for Fc1510
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4 February 2013
- 14:5014:50, 4 February 2013 diff hist +1,080 Rep:Mod:FRC1510 →REFERENCES
- 14:3914:39, 4 February 2013 diff hist 0 N File:CHAIR TS 321G.chk No edit summary current
- 14:2014:20, 4 February 2013 diff hist +30 Rep:Mod:FRC1510 →Optimisation and Frequency Analysis of the boat transition state using the QST2 method
- 14:2014:20, 4 February 2013 diff hist +21 Rep:Mod:FRC1510 →Optimisation and Frequency Analysis of the boat transition state using the QST2 method
- 14:1914:19, 4 February 2013 diff hist +141 Rep:Mod:FRC1510 →Optimisation and Frequency Analysis of the boat transition state using the QST2 method
- 14:1814:18, 4 February 2013 diff hist 0 N File:BOAT TS LABELLED.png No edit summary current
- 14:1414:14, 4 February 2013 diff hist −20 Rep:Mod:FRC1510 →Optimisation and Frequency Analysis of the boat transition state using the QST2 method
- 14:1314:13, 4 February 2013 diff hist +313 Rep:Mod:FRC1510 →Optimising the chair transition state using the frozen coordinate method.
- 13:5513:55, 4 February 2013 diff hist −1 Rep:Mod:FRC1510 →Module 3: Week 1: Optimizing the "Chair" and "Boat" Transition Structures
- 13:5213:52, 4 February 2013 diff hist +522 Rep:Mod:FRC1510 →Module 3: Week 1: Optimizing the "Chair" and "Boat" Transition Structures
- 13:5213:52, 4 February 2013 diff hist 0 N File:IR SPECTRA UNFROZEN.png No edit summary current
- 13:3013:30, 4 February 2013 diff hist +125 Rep:Mod:FRC1510 →Optimising the chair transition state using the frozen coordinate method.
- 13:2813:28, 4 February 2013 diff hist 0 N File:CHAIR TS UNFROZEN.png No edit summary current
- 13:2513:25, 4 February 2013 diff hist 0 Rep:Mod:FRC1510 →Optimising the chair transition state using the frozen coordinate method.
- 13:2513:25, 4 February 2013 diff hist +1,106 Rep:Mod:FRC1510 →Module 3: Week 1: Optimizing the "Chair" and "Boat" Transition Structures
- 13:1513:15, 4 February 2013 diff hist 0 N File:CHAIR TS UNFROZEN3.out No edit summary current
1 February 2013
- 13:2513:25, 1 February 2013 diff hist +314 Rep:Mod:FRC1510 →Optimisation and Frequency Analysis of the boat transition state using the QST2 method
- 13:1813:18, 1 February 2013 diff hist +18 Rep:Mod:FRC1510 →Frequency Analysis of the 631-G(d) basis set of the app conformation of 1,5-hexadiene
- 13:1813:18, 1 February 2013 diff hist +44 Rep:Mod:FRC1510 →Optimising the chair transition state computing the force constant matrix
- 13:1713:17, 1 February 2013 diff hist +1,015 Rep:Mod:FRC1510 →Optimisation and Frequency Analysis of the boat transition state using the QST2 method
- 13:1313:13, 1 February 2013 diff hist 0 N File:IR SPECTRA BOAT TS 321G.png No edit summary current
- 12:5912:59, 1 February 2013 diff hist 0 N File:BOAT2 TS 321G.png No edit summary current
- 12:5812:58, 1 February 2013 diff hist 0 N File:BOAT TS 321G.png No edit summary current
31 January 2013
- 17:4417:44, 31 January 2013 diff hist +105 Rep:Mod:FRC1510 →Optimisation and Frequency Analysis of the boat transition state using the QST2 method
- 17:1617:16, 31 January 2013 diff hist −5 Rep:Mod:FRC1510 →Optimisation and Frequency Analysis of the boat transition state using the QST2 method
- 17:1617:16, 31 January 2013 diff hist +854 Rep:Mod:FRC1510 →Optimising the chair transition state using the frozen coordinate method.
- 17:1217:12, 31 January 2013 diff hist 0 N File:BOAT5 TS 321G.LOG No edit summary current
- 17:0417:04, 31 January 2013 diff hist 0 N File:BOAT TS REACTANT PRODUCT 321G.png No edit summary current
29 January 2013
- 16:4116:41, 29 January 2013 diff hist +87 Rep:Mod:FRC1510 →Optimising the transition state computing the force constant matrix
- 14:5714:57, 29 January 2013 diff hist +458 Rep:Mod:FRC1510 →Optimising the transition state computing the force constant matrix
- 14:5414:54, 29 January 2013 diff hist 0 N File:IR SPECTRA CHAIR TS 321G.png No edit summary current
- 14:5114:51, 29 January 2013 diff hist +24 Rep:Mod:FRC1510 →Optimising the transition state computing the force constant matrix
- 14:2514:25, 29 January 2013 diff hist +377 Rep:Mod:FRC1510 →Optimising the transition state computing the force constant matrix
- 14:0614:06, 29 January 2013 diff hist +262 Rep:Mod:FRC1510 →Optimising the transition state computing the force constant matrix
- 11:5811:58, 29 January 2013 diff hist 0 Rep:Mod:FRC1510 →Optimising the transition state computing the force constant matrix
- 11:5711:57, 29 January 2013 diff hist +87 m Rep:Mod:FRC1510 →Optimising the transition state computing the force constant matrix
- 11:5411:54, 29 January 2013 diff hist +63 Rep:Mod:FRC1510 →Optimising the transition state computing the force constant matrix
- 11:5411:54, 29 January 2013 diff hist +269 Rep:Mod:FRC1510 →Optimising the first half of the transition state
- 11:5311:53, 29 January 2013 diff hist 0 N File:CHAIR TS 321G.LOG No edit summary current
- 11:4211:42, 29 January 2013 diff hist 0 N File:CHAIR TS 321G.png No edit summary current
- 11:0211:02, 29 January 2013 diff hist +107 Rep:Mod:FRC1510 →Optimising the first half of the transition state
- 10:5710:57, 29 January 2013 diff hist +745 Rep:Mod:FRC1510 →Optimising the first half of the transition state
- 10:4510:45, 29 January 2013 diff hist 0 N File:C3H5 OPT.chk No edit summary current
- 10:4410:44, 29 January 2013 diff hist 0 N File:C3H5 OPT.LOG No edit summary current
- 10:4310:43, 29 January 2013 diff hist +343 Rep:Mod:FRC1510 →REFERENCES
- 10:4010:40, 29 January 2013 diff hist 0 File:C3H5 OPT.png uploaded a new version of "File:C3H5 OPT.png" current
- 10:4010:40, 29 January 2013 diff hist 0 N File:C3H5 OPT.png No edit summary
- 10:1910:19, 29 January 2013 diff hist +352 Rep:Mod:FRC1510 →Frequency Analysis