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Uploads by Am12618

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Date Name Thumbnail Size Description Versions
16:00, 13 May 2020 AM Dynamics Calculation with r1 = rts+1 pm, r2 = rts and p1 = p2 = 0.png (file) 27 KB   1
15:58, 13 May 2020 AM. MEP calculation with r1 = rts+1 pm, r2 = rts and p1 = p2 = 0.png (file) 26 KB   1
15:30, 13 May 2020 Contour Plot of the best estimate of the transition state position(r1=r2=90.775 pm).png (file) 157 KB   1
16:17, 15 March 2019 HOMO LUMO AM.PNG (file) 144 KB   1
15:34, 15 March 2019 Molecule labels.PNG (file) 22 KB   1
10:46, 15 March 2019 2AM MO 15.PNG (file) 59 KB   1
10:46, 15 March 2019 2AM MO 13.PNG (file) 71 KB   1
10:46, 15 March 2019 2AM MO 10.PNG (file) 67 KB   1
10:45, 15 March 2019 2AM MO 9.PNG (file) 58 KB   1
10:14, 15 March 2019 AM MO 15.PNG (file) 73 KB   1
10:00, 15 March 2019 AM MO 13.PNG (file) 84 KB   1
09:55, 15 March 2019 AM MO 10.PNG (file) 64 KB   1
09:50, 15 March 2019 AM MO 9.PNG (file) 74 KB   1
09:48, 15 March 2019 AM MO 1.PNG (file) 34 KB   1
08:52, 15 March 2019 AM2 Display Vibrations ClF3.PNG (file) 15 KB   1
08:51, 15 March 2019 AM2 Display Vibrations H2.PNG (file) 13 KB   1
08:51, 15 March 2019 AM2 Display Vibrations N2.PNG (file) 13 KB   1
08:50, 15 March 2019 AM2 Display Vibrations NH3.PNG (file) 15 KB   1
08:46, 15 March 2019 Charge distribution1.PNG (file) 15 KB   1
08:45, 15 March 2019 2charge distribution H2.PNG (file) 8 KB   1
08:41, 15 March 2019 2Charge distribution on N2 molecule am.PNG (file) 27 KB Charge on nitrogen molecule 1
08:39, 15 March 2019 2Charge distribution on NH3 molecule am12618.PNG (file) 24 KB   1
17:19, 14 March 2019 AM Display Vibrations ClF3.PNG (file) 18 KB   1
17:17, 14 March 2019 AM Display Vibrations H2.PNG (file) 16 KB   1
17:17, 14 March 2019 AM Display vibrations N2.PNG (file) 13 KB   1
17:15, 14 March 2019 AM Display Vibrations NH3.PNG (file) 15 KB   1
16:35, 14 March 2019 ATHINAMASOURA2 AM12618 PHUNT CLF3 OPTF POP.LOG (file) 602 KB   1
16:03, 14 March 2019 Transition Metal complex YECMOL withbonddistance.PNG (file) 5 KB   1
15:41, 14 March 2019 AthinaMasoura am12618 PHunt h2 optf pop.LOG (file) 95 KB   2
15:34, 14 March 2019 AthinaMasoura am12618 PHunt N2 optf pop.LOG (file) 196 KB Reverted to version as of 15:24, 14 March 2019 3
12:19, 14 March 2019 Charge distribution2.PNG (file) 19 KB   1
12:09, 14 March 2019 Vibrational mode clf3 6.PNG (file) 19 KB   1
12:09, 14 March 2019 Vibrational mode clf3 5.PNG (file) 19 KB   1
12:09, 14 March 2019 Vibrational mode clf3 4.PNG (file) 23 KB   1
12:08, 14 March 2019 Vibrational mode clf3 3.PNG (file) 24 KB   1
12:08, 14 March 2019 Vibrational mode clf3 2.PNG (file) 26 KB   1
12:06, 14 March 2019 Vibrational mode clf3 1.PNG (file) 26 KB   1
10:38, 14 March 2019 Transition metal complex.PNG (file) 6 KB   1
09:47, 14 March 2019 Transition Metal complex YECMOL.PNG (file) 4 KB   1
09:43, 14 March 2019 Mono-metallic TM complex that coordinates N2 YECMOL.cqs (file) 232 KB Transition Metal complex with N2 Name: YECMOL 1
09:23, 14 March 2019 Charge distribution H2.PNG (file) 20 KB   1
09:19, 14 March 2019 Vibrational Mode of H2.PNG (file) 19 KB   1
08:58, 14 March 2019 ATHINAMASOURA AM12618 PHUNT NH3 OPTF POP.LOG (file) 228 KB   1
08:36, 14 March 2019 Charge distribution on N2 molecule am.PNG (file) 9 KB Charge distribution on nitrogen molecule. The colour black indicates the 0 charge on each nitrogen atom 1
08:22, 14 March 2019 N2 vibrational mode.PNG (file) 22 KB N2 vibrational mode 1
16:16, 13 March 2019 Charge distribution on NH3 molecule am12618.PNG (file) 27 KB   1
16:00, 13 March 2019 6.2.PNG (file) 27 KB Vibrational mode 6 of NH3 molecule 1
15:57, 13 March 2019 4.2.PNG (file) 29 KB Vibrational mode 4 of the NH3 molecule 1
15:54, 13 March 2019 3.2.PNG (file) 30 KB Vibrational mode 3 of NH3 1
14:18, 13 March 2019 AthinaMasoura am12618 PHunt nh3 optf pop.gjf (file) 457 bytes   1
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