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- 09:43, 22 May 2026 diff hist +9,828 Ibarramyes
- 09:42, 22 May 2026 diff hist +4,637 Clauseluke current
- 06:54, 22 May 2026 diff hist -4,637 m Clauseluke Reverted edits by Clauseluke (talk) to last revision by Qurat Tag: Rollback
- 06:53, 22 May 2026 diff hist -2,295 Ibarramyes Undo revision 31064 by Ibarramyes (talk) Tag: Undo
- 06:52, 22 May 2026 diff hist -7,533 Ibarramyes Undo revision 31065 by Ibarramyes (talk) Tag: Undo
- 06:51, 22 May 2026 diff hist +9,828 Ibarramyes Undo revision 31066 by Wikiadmin (talk) Tag: Undo
- 06:50, 22 May 2026 diff hist -9,828 m Ibarramyes Reverted edits by Ibarramyes (talk) to last revision by Qurat Tag: Rollback
- 05:02, 24 March 2026 diff hist 0 m User talk:MergedUsers Wikiadmin moved page User talk:Nelsonsimo to User talk:MergedUsers: Automatically moved page while merging the account "Nelsonsimo" to "MergedUsers" current
- 08:43, 10 December 2025 diff hist -6 Mod:Hunt Research Group/AdditionalFunctions.py →Required arguments current
- 08:42, 10 December 2025 diff hist 0 Mod:Hunt Research Group/AdditionalFunctions.py
- 08:41, 10 December 2025 diff hist 0 N File:Ia2514 fig5.png current
- 08:39, 10 December 2025 diff hist 0 N File:Ia2514 fig10.png current
- 05:23, 10 December 2025 diff hist +216 Mod:Hunt Research Group/report writing →"have been" or "were"? current
- 01:23, 9 December 2025 diff hist -133 Mod:Hunt Research Group/Python scripts for cube files →Getting started current
- 01:22, 9 December 2025 diff hist +5 Mod:Hunt Research Group/Python scripts for cube files →Getting started
- 19:59, 7 December 2025 diff hist +38 Mod:Hunt Research Group/SAPT →Run interactively current
- 19:58, 7 December 2025 diff hist -15 Mod:Hunt Research Group/SAPT →Run interactively
- 19:56, 7 December 2025 diff hist +1 Mod:Hunt Research Group/SAPT →Run interactively
- 19:53, 7 December 2025 diff hist -14 Mod:Hunt Research Group/SAPT →Run interactively
- 19:53, 7 December 2025 diff hist +114 Mod:Hunt Research Group/SAPT →Run interactively
- 19:50, 7 December 2025 diff hist +184 Mod:Hunt Research Group/SAPT →Run interactively
- 19:54, 4 December 2025 diff hist +61 Mod:Hunt Research Group/SAPT →Run interactively
- 19:53, 4 December 2025 diff hist -98 Mod:Hunt Research Group/SAPT →Run a test job
- 19:53, 4 December 2025 diff hist -55 Mod:Hunt Research Group/SAPT →Run SAPT calculations using Psi4
- 19:52, 4 December 2025 diff hist -6 Mod:Hunt Research Group/SAPT
- 19:48, 4 December 2025 diff hist +1 Mod:Hunt Research Group/SAPT
- 17:53, 13 November 2025 diff hist -1 Mod:Hunt Research Group:restart symbolic zmat →run the job current
- 17:52, 13 November 2025 diff hist +52 Mod:Hunt Research Group:restart symbolic zmat →run the job
- 17:52, 13 November 2025 diff hist +14 Mod:Hunt Research Group:restart symbolic zmat →create an input file
- 17:52, 13 November 2025 diff hist +215 Mod:Hunt Research Group:restart symbolic zmat →create an input file
- 17:49, 13 November 2025 diff hist +8 Mod:Hunt Research Group:restart symbolic zmat →run the job
- 17:49, 13 November 2025 diff hist +82 Mod:Hunt Research Group:restart symbolic zmat
- 17:47, 13 November 2025 diff hist +3,675 Mod:Hunt Research Group:restart symbolic zmat
- 17:46, 13 November 2025 diff hist 0 Mod:Hunt Research Group:restart symbolic zmat →run the job
- 17:45, 13 November 2025 diff hist +1 Mod:Hunt Research Group:restart symbolic zmat →run the job
- 17:45, 13 November 2025 diff hist +2 Mod:Hunt Research Group:restart symbolic zmat →run the job
- 17:44, 13 November 2025 diff hist -6 Mod:Hunt Research Group:restart symbolic zmat →run the job
- 17:44, 13 November 2025 diff hist +810 N Mod:Hunt Research Group:restart symbolic zmat Created page with "=create an input file= *extract the final geometry from the optimisation log file first :: extract_structure.py filename (on your log file with without the .log extension) ::..."
- 17:39, 13 November 2025 diff hist +359 HRG:HuntResearchGRoup →to build new files from data or existing files
- 01:24, 23 October 2025 diff hist +701 Mod:Hunt Research Group:molecules in an electric field →scan a coordinate current
- 01:19, 23 October 2025 diff hist +2,046 Mod:Hunt Research Group:molecules in an electric field →scan a coordinate
- 23:11, 22 October 2025 diff hist +491 Mod:Hunt Research Group:molecules in an electric field →orientate to the dipole
- 20:11, 22 October 2025 diff hist +45 Mod:Hunt Research Group/z-matrix →Links to G16 manual pages current
- 20:10, 22 October 2025 diff hist +339 Mod:Hunt Research Group/z-matrix →Links to G16 manual pages
- 20:06, 22 October 2025 diff hist +90 Mod:Hunt Research Group/z-matrix →Partial optimisations, scans and the z-matrix
- 19:13, 22 October 2025 diff hist 0 File:Water field file.png Wikiadmin uploaded a new version of File:Water field file.png current
- 19:11, 22 October 2025 diff hist +4 Mod:Hunt Research Group:molecules in an electric field →a code to orient the molecule
- 19:05, 22 October 2025 diff hist -117 Mod:Hunt Research Group:molecules in an electric field →a code to orient the molecule
- 19:03, 22 October 2025 diff hist +54 Mod:Hunt Research Group:molecules in an electric field →a code to orient the molecule
- 18:57, 22 October 2025 diff hist +9 Mod:Hunt Research Group/pos zmat current
