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Showing below up to 50 results in range #5,551 to #5,600.

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  1. (download) 01349769 screenshot MO4 O2.png . . 1,426 × 603 . . 69 KB . . As6918 . . 20:04, 7 March 2019
  2. (download) 01349769 screenshot MO5 O2.png . . 1,299 × 638 . . 90 KB . . As6918 . . 20:11, 7 March 2019
  3. (download) 01349769 screenshot Cl2 opt.png . . 424 × 491 . . 21 KB . . As6918 . . 22:27, 7 March 2019
  4. (download) 01349769 screenshot 520Freq Cl2 opt.png . . 578 × 274 . . 20 KB . . As6918 . . 09:14, 8 March 2019
  5. (download) Q4 1 01349768.png . . 500 × 500 . . 159 KB . . As6918 . . 03:43, 20 May 2020
  6. (download) Q4 2 01349769.png . . 500 × 500 . . 158 KB . . As6918 . . 03:44, 20 May 2020
  7. (download) Q4 3 01349769.png . . 500 × 500 . . 159 KB . . As6918 . . 03:44, 20 May 2020
  8. (download) Q4 4 01349769.png . . 640 × 480 . . 180 KB . . As6918 . . 03:45, 20 May 2020
  9. (download) Q4 5 01349769.png . . 640 × 480 . . 182 KB . . As6918 . . 03:46, 20 May 2020
  10. (download) Q2 MRD 01349769.png . . 609 × 457 . . 29 KB . . As6918 . . 03:29, 21 May 2020
  11. (download) Q3 MRD 01349769.png . . 640 × 480 . . 177 KB . . As6918 . . 03:29, 21 May 2020
  12. (download) Q3 MRD2 01349769.png . . 619 × 474 . . 172 KB . . As6918 . . 03:30, 21 May 2020
  13. (download) Q4 1 01349769.png . . 625 × 466 . . 173 KB . . As6918 . . 04:05, 21 May 2020
  14. (download) Surfaceplot 1 01349769.png . . 500 × 500 . . 121 KB . . As6918 . . 06:56, 22 May 2020
  15. (download) Surfaceplot 2 01349769.png . . 500 × 500 . . 99 KB . . As6918 . . 07:01, 22 May 2020
  16. (download) NH3 Final Set of Optimised Parameters.png . . 905 × 824 . . 248 KB . . Asg17 . . 10:17, 2 March 2018
  17. (download) NH3 Total Energy Graph Optimisation.png . . 581 × 474 . . 128 KB . . Asg17 . . 10:39, 2 March 2018
  18. (download) NH3 RMS Gradient Norm Optimisation.png . . 779 × 637 . . 165 KB . . Asg17 . . 10:39, 2 March 2018
  19. (download) NH3 Vibrational Frequencies.png . . 1,064 × 369 . . 186 KB . . Asg17 . . 11:03, 2 March 2018
  20. (download) H2 Final Set of Optimised Parameters.png . . 888 × 1,062 . . 299 KB . . Asg17 . . 12:17, 2 March 2018
  21. (download) N2 Final Set of Optimised Parameters.png . . 884 × 569 . . 178 KB . . Asg17 . . 12:32, 2 March 2018
  22. (download) N2 Molecular Orbitals.png . . 607 × 458 . . 165 KB . . Asg17 . . 12:55, 2 March 2018
  23. (download) H2 Molecular Orbitals.png . . 764 × 580 . . 222 KB . . Asg17 . . 13:05, 2 March 2018
  24. (download) NH3 Molecular Orbitals.png . . 686 × 715 . . 300 KB . . Asg17 . . 13:08, 2 March 2018
  25. (download) O2 Final Set of Optimised Parameters.png . . 902 × 567 . . 180 KB . . Asg17 . . 13:35, 2 March 2018
  26. (download) O2 Total Energy Graph Optimisation.png . . 670 × 545 . . 207 KB . . Asg17 . . 13:45, 2 March 2018
  27. (download) O2 RMS Gradient Norm Optimisation.png . . 826 × 629 . . 158 KB . . Asg17 . . 13:46, 2 March 2018
  28. (download) O2 Charge Analysis.png . . 506 × 262 . . 72 KB . . Asg17 . . 14:11, 2 March 2018
  29. (download) O2 Molecular Orbitals.png . . 1,072 × 765 . . 346 KB . . Asg17 . . 14:19, 2 March 2018
  30. (download) O2 Vibrational Frequencies.png . . 540 × 61 . . 22 KB . . Asg17 . . 14:23, 2 March 2018
  31. (download) Asp216 nh3 opt vibrations.png . . 405 × 454 . . 17 KB . . Asp216 . . 10:59, 27 February 2017
  32. (download) Asp216 h2 opt vibrations.PNG . . 403 × 454 . . 17 KB . . Asp216 . . 19:33, 27 February 2017
  33. (download) Asp216 n2 opt vibrations.PNG . . 403 × 454 . . 17 KB . . Asp216 . . 19:33, 27 February 2017
  34. (download) Asp216 bh4 opt vibrations.PNG . . 403 × 454 . . 20 KB . . Asp216 . . 11:48, 2 March 2017
  35. (download) Asp216 h2sio opt vibrations.PNG . . 403 × 454 . . 19 KB . . Asp216 . . 11:50, 2 March 2017
  36. (download) Asp216 bh4 opt mo1.PNG . . 533 × 758 . . 49 KB . . Asp216 . . 12:03, 3 March 2017
  37. (download) Asp216 bh4 opt mo3.PNG . . 533 × 758 . . 48 KB . . Asp216 . . 12:06, 3 March 2017
  38. (download) Asp216 bh4 opt mo4.PNG . . 533 × 758 . . 51 KB . . Asp216 . . 12:07, 3 March 2017
  39. (download) Asp216 bh4 opt mo5.PNG . . 533 × 758 . . 48 KB . . Asp216 . . 12:07, 3 March 2017
  40. (download) Asp216 bh4 opt mo6.PNG . . 533 × 758 . . 59 KB . . Asp216 . . 12:07, 3 March 2017
  41. (download) Asp216 h2sio opt mo3.PNG . . 541 × 758 . . 43 KB . . Asp216 . . 12:21, 3 March 2017
  42. (download) Asp216 h2sio opt mo4.PNG . . 541 × 758 . . 43 KB . . Asp216 . . 12:21, 3 March 2017
  43. (download) Asp216 h2sio opt mo10.PNG . . 541 × 758 . . 59 KB . . Asp216 . . 12:21, 3 March 2017
  44. (download) Asp216 h2sio opt mo12.PNG . . 541 × 758 . . 66 KB . . Asp216 . . 12:22, 3 March 2017
  45. (download) Asp216 h2sio opt mo13.PNG . . 541 × 758 . . 53 KB . . Asp216 . . 12:22, 3 March 2017
  46. (download) Asp216 mrd R ts dist vs time.png . . 500 × 496 . . 10 KB . . Asp216 . . 15:18, 1 May 2018
  47. (download) Asp216 mrd R ts mom vs time.png . . 640 × 476 . . 54 KB . . Asp216 . . 15:19, 1 May 2018
  48. (download) Asp216 mrd Trajectory initial final.png . . 500 × 496 . . 74 KB . . Asp216 . . 13:39, 3 May 2018
  49. (download) Asp216 mrd plot p -1.25 -2.5.png . . 500 × 492 . . 107 KB . . Asp216 . . 14:01, 3 May 2018
  50. (download) Asp216 mrd plot p -1.5 -2.0.png . . 500 × 488 . . 106 KB . . Asp216 . . 14:07, 3 May 2018

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