User contributions for Ja1915
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17 December 2017
- 18:2018:20, 17 December 2017 diff hist +31 Rep:Ja1915MgO →The calculation of the Free Energy using the Quasi-Harmonic approximation
- 18:1918:19, 17 December 2017 diff hist +83 Rep:Ja1915MgO →The calculation of the Free Energy using the Quasi-harmonic approximation
- 18:1818:18, 17 December 2017 diff hist +5 Rep:Ja1915MgO →Calculation of the Free Energy using the harmonic approximation
- 18:1718:17, 17 December 2017 diff hist +6 Rep:Ja1915MgO →The calculation of the Free Energy using the harmonic approximation
- 18:1718:17, 17 December 2017 diff hist +5,765 Rep:Ja1915MgO →The calculation of the Free Energy using the harmonic approximation
- 18:1618:16, 17 December 2017 diff hist +4,654 Rep:Ja1915MgO →Calculating the phonon modes of MgO
- 18:1318:13, 17 December 2017 diff hist +2,503 Rep:Ja1915MgO →Molecular Dynamics
- 18:1018:10, 17 December 2017 diff hist +4,104 Rep:Ja1915MgO →Investigation Aims
- 18:0518:05, 17 December 2017 diff hist +5,651 Rep:Ja1915MgO No edit summary
- 18:0018:00, 17 December 2017 diff hist +36 N Rep:Ja1915MgO Created page with "<nowiki>== Section Title ==</nowiki>" Tag: Visual edit
8 November 2017
- 11:4811:48, 8 November 2017 diff hist +1 Rep:Ja1915 Computational 2017 →Introduction
- 11:4611:46, 8 November 2017 diff hist +54 Rep:Ja1915 Computational 2017 →Introduction
- 11:4411:44, 8 November 2017 diff hist +39 Rep:Ja1915 Computational 2017 →Conclusion
- 11:4311:43, 8 November 2017 diff hist +66 Rep:Ja1915 Computational 2017 →Xylelene Stability Issues
- 11:4011:40, 8 November 2017 diff hist −62 Rep:Ja1915 Computational 2017 →Thermochemistry
- 11:3911:39, 8 November 2017 diff hist −9 Rep:Ja1915 Computational 2017 →IRC
- 11:3811:38, 8 November 2017 diff hist −88 Rep:Ja1915 Computational 2017 →Thermochemistry
- 11:3311:33, 8 November 2017 diff hist −6 Rep:Ja1915 Computational 2017 →Vibrational Bond Analysis
- 11:3311:33, 8 November 2017 diff hist +79 Rep:Ja1915 Computational 2017 →Vibrational Bond Analysis
- 11:2411:24, 8 November 2017 diff hist +24 Rep:Ja1915 Computational 2017 →Bond Length Analysis
- 11:2211:22, 8 November 2017 diff hist −43 Rep:Ja1915 Computational 2017 →Molecular Orbital Diagram and Analysis
- 11:1911:19, 8 November 2017 diff hist 0 Rep:Ja1915 Computational 2017 →Molecular Orbital Diagram and Analysis
- 11:1611:16, 8 November 2017 diff hist +7 Rep:Ja1915 Computational 2017 →Computational methods
- 11:1211:12, 8 November 2017 diff hist −5 Rep:Ja1915 Computational 2017 →Introduction
- 11:1111:11, 8 November 2017 diff hist +3 Rep:Ja1915 Computational 2017 →Introduction
- 11:1111:11, 8 November 2017 diff hist +186 Rep:Ja1915 Computational 2017 →Introduction
- 11:1011:10, 8 November 2017 diff hist 0 N File:Ja1915-Frequency.PNG No edit summary current
- 10:5910:59, 8 November 2017 diff hist −284 Rep:Ja1915 Computational 2017 →Introduction
- 10:5710:57, 8 November 2017 diff hist −10 Rep:Ja1915 Computational 2017 →Log files
- 10:5610:56, 8 November 2017 diff hist −28 Rep:Ja1915 Computational 2017 →Log files
- 10:4610:46, 8 November 2017 diff hist +1 Rep:Ja1915 Computational 2017 →Molecular Orbital Diagram and Analysis
- 10:4410:44, 8 November 2017 diff hist +2 Rep:Ja1915 Computational 2017 →Molecular Orbital Diagram and Analysis
- 10:3710:37, 8 November 2017 diff hist −1 Rep:Ja1915 Computational 2017 →Bond Length Analysis
- 10:3610:36, 8 November 2017 diff hist +112 Rep:Ja1915 Computational 2017 →Vibrational Bond Analysis
- 10:3410:34, 8 November 2017 diff hist +524 Rep:Ja1915 Computational 2017 →Thermochemistry
- 10:2810:28, 8 November 2017 diff hist 0 Rep:Ja1915 Computational 2017 →Log files
- 10:2410:24, 8 November 2017 diff hist +20 Rep:Ja1915 Computational 2017 →Log files
- 10:2110:21, 8 November 2017 diff hist −2 Rep:Ja1915 Computational 2017 →Log files
- 10:2010:20, 8 November 2017 diff hist +7 Rep:Ja1915 Computational 2017 →Log files
- 10:0710:07, 8 November 2017 diff hist +3 Rep:Ja1915 Computational 2017 →Log files
- 10:0310:03, 8 November 2017 diff hist +384 Rep:Ja1915 Computational 2017 →Log files
- 10:0110:01, 8 November 2017 diff hist 0 N File:Ja1915-CHELATROPICTSOPTIRC.LOG No edit summary current
- 09:5909:59, 8 November 2017 diff hist 0 N File:Ja1915-Other-Diels-EXOPM6.LOG No edit summary current
- 09:5709:57, 8 November 2017 diff hist 0 N File:Ja1915-XYLELENE-PM6.LOG No edit summary current
- 09:5609:56, 8 November 2017 diff hist 0 N File:Ja1915-SO2-PM6.LOG No edit summary current
- 09:5509:55, 8 November 2017 diff hist 0 N File:Ja1915-Other-diels-ENDOPM6.LOG No edit summary current
- 09:5409:54, 8 November 2017 diff hist 0 N File:Ja1915-EXOEXCERCISE3IRC.LOG No edit summary current
- 09:5209:52, 8 November 2017 diff hist 0 N File:Ja1915-ENDOIRCEXCERCISE3.LOG No edit summary current
- 09:5109:51, 8 November 2017 diff hist 0 N File:Ja1915-CHELATROPICTSOPTPM6.LOG No edit summary current
- 09:5109:51, 8 November 2017 diff hist 0 N File:Ja1915-ENDOPM6EXCERCISE 3.LOG No edit summary current