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User contributions for Ach2718

Results for Ach2718 talk block log uploads logs

A user with 485 edits. Account created on 1 March 2019.

11:4411:44, 17 March 2019 diff hist +6 Rep:Mod:ach2718 →Optimised file link
11:4311:43, 17 March 2019 diff hist +103 Rep:Mod:ach2718 →N2 Molecule
11:4111:41, 17 March 2019 diff hist −3 Rep:Mod:ach2718 →N2 Molecule
11:4011:40, 17 March 2019 diff hist −8 Rep:Mod:ach2718 →NH3 Molecule
11:3811:38, 17 March 2019 diff hist +28 Rep:Mod:ach2718 →Jmol image
11:3711:37, 17 March 2019 diff hist 0 Rep:Mod:ach2718 →Jmol image
11:3611:36, 17 March 2019 diff hist +209 Rep:Mod:ach2718 →N2 Molecule
11:3511:35, 17 March 2019 diff hist 0 N File:ACH2718 N2 OPTIMISATION3.LOG No edit summary current
11:3011:30, 17 March 2019 diff hist +330 Rep:Mod:ach2718 →N2 Molecule
11:2711:27, 17 March 2019 diff hist +211 Rep:Mod:ach2718 →N2 Molecule
11:0611:06, 17 March 2019 diff hist +31 Rep:Mod:ach2718 No edit summary

18:2418:24, 15 March 2019 diff hist +772 Rep:Mod:ach2718 →Charge Analysis
18:1918:19, 15 March 2019 diff hist +41 Rep:Mod:ach2718 →Charge Analysis
18:1818:18, 15 March 2019 diff hist 0 N File:Ach2718 nh3 chargeanalysis.PNG No edit summary current
18:1718:17, 15 March 2019 diff hist +25 Rep:Mod:ach2718 →NH3 Molecule
18:1518:15, 15 March 2019 diff hist +839 Rep:Mod:ach2718 →NH3 Molecule
18:0318:03, 15 March 2019 diff hist +13 Rep:Mod:ach2718 →Vibrations
18:0218:02, 15 March 2019 diff hist −99 Rep:Mod:ach2718 →Vibrations
17:5817:58, 15 March 2019 diff hist +36 Rep:Mod:ach2718 →Vibrations
17:5717:57, 15 March 2019 diff hist +24 Rep:Mod:ach2718 →Vibrations
17:5517:55, 15 March 2019 diff hist 0 N File:Ach2718 nh3 vibrationalmode1.png No edit summary current
17:5417:54, 15 March 2019 diff hist +227 Rep:Mod:ach2718 →Vibrations
17:5317:53, 15 March 2019 diff hist 0 N File:Ach2718 nh3 vibrationalmode6.PNG No edit summary current
17:5217:52, 15 March 2019 diff hist 0 N File:Ach2718 nh3 vibrationalmode5.PNG No edit summary current
17:5217:52, 15 March 2019 diff hist 0 N File:Ach2718 nh3 vibrationalmode4.PNG No edit summary current
17:5217:52, 15 March 2019 diff hist 0 N File:Ach2718 nh3 vibrationalmode3.PNG No edit summary current
17:5117:51, 15 March 2019 diff hist 0 N File:Ach2718 nh3 vibrationalmode2.PNG No edit summary current
17:5117:51, 15 March 2019 diff hist 0 N File:Ach2718 nh3 vibrationalmode1.PNG No edit summary current
17:5117:51, 15 March 2019 diff hist +362 Rep:Mod:ach2718 →NH3 Molecule
17:1317:13, 15 March 2019 diff hist +43 Rep:Mod:ach2718 →NH3 Molecule
17:1117:11, 15 March 2019 diff hist 0 N File:Ach2718 nh3 vibrations info.PNG No edit summary current
17:0617:06, 15 March 2019 diff hist +49 Rep:Mod:ach2718 →NH3 Molecule
16:5916:59, 15 March 2019 diff hist +23 Rep:Mod:ach2718 →NH3 Molecule
16:4616:46, 15 March 2019 diff hist +28 Rep:Mod:ach2718 →Jmol dynamic image
16:4416:44, 15 March 2019 diff hist +747 N Rep:Mod:ach2718 Created page with "== NH<sub>3</sub> Molecule == ==== Calculation Method ==== RB3LYP ==== Basis set ==== 6-31G(d.p) ==== Final energy ==== -56.44397188 au ====Point group ==== C<sub>3v</sub> {|..."

15:4815:48, 14 March 2019 diff hist +73 Ach2718 →NH3 Molecule current
15:4515:45, 14 March 2019 diff hist +3 Ach2718 →Jmol dynamic image
15:4515:45, 14 March 2019 diff hist +1 Ach2718 →Jmol dynamic image
15:4115:41, 14 March 2019 diff hist 0 N File:ACH2718 NH3 OPT 3.LOG No edit summary current
15:3815:38, 14 March 2019 diff hist 0 Ach2718 →Jmol dynamic image
15:3115:31, 14 March 2019 diff hist 0 Ach2718 →Jmol dynamic image
15:2815:28, 14 March 2019 diff hist 0 Ach2718 →Jmol dynamic image
15:2815:28, 14 March 2019 diff hist +7 Ach2718 →Jmol dynamic image
15:2615:26, 14 March 2019 diff hist −3 Ach2718 →Jmol dynamic image
15:2315:23, 14 March 2019 diff hist +207 Ach2718 →NH3 Molecule
15:2115:21, 14 March 2019 diff hist 0 Ach2718 No edit summary
15:2015:20, 14 March 2019 diff hist −1 Ach2718 →NH3 Molecule
15:1915:19, 14 March 2019 diff hist +174 Ach2718 No edit summary
15:0515:05, 14 March 2019 diff hist +286 N Ach2718 Created page with "{|class="wikitable" border="1" |+ Table for NH3 ! Item !! Value !! Threshold !! Converged? |- |Maximum Force || 0.000004 || 0.000450 || YES |- | RMS Force || 0.000004 || 0.000..."

15:2715:27, 1 March 2019 diff hist +16 N Rep:Mod:Ach2718 Created page with "==NH3 Molecule=="

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