Attachment 'Reference interaction energies for double-H-bonded dimers'

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  • [get | view] (2021-02-16 12:59:04, 1.1 KB) [[attachment:Part of Orient output]]
  • [get | view] (2021-02-16 13:02:10, 1.1 KB) [[attachment:Pyridine dimer stacked S1 _ SAPT(DFT)]]
  • [get | view] (2021-02-16 13:01:39, 1.3 KB) [[attachment:Pyridine dimer stacked S1 geometry]]
  • [get | view] (2021-02-16 12:59:39, 1.5 KB) [[attachment:Reference interaction energies for double-H-bonded dimers]]
  • [get | view] (2021-02-16 13:03:32, 1.1 KB) [[attachment:Stacked S2 SAPT(DFT) interaction energies]]
  • [get | view] (2021-02-16 13:02:57, 1.3 KB) [[attachment:Stacked S2 geometry file]]
  • [get | view] (2021-02-16 13:04:25, 1.1 KB) [[attachment:T1 H-bonded dimer SAPT(DFT) energies]]
  • [get | view] (2021-02-16 13:04:10, 1.3 KB) [[attachment:T1 H-bonded dimer geometry]]
  • [get | view] (2021-02-16 12:35:54, 482.2 KB) [[attachment:ajm_orient_dispersion_misquitta_stone_molphys106.pdf]]
  • [get | view] (2021-02-16 12:36:11, 1539.5 KB) [[attachment:atom_atom_potentials_stone_misquitta_irpc26.pdf]]
  • [get | view] (2021-02-16 12:36:49, 305.0 KB) [[attachment:beyond_pairwise_additivity_in_london_dispersion_interactions_dobson14a_ijqc114.pdf]]
  • [get | view] (2021-02-16 12:36:28, 527.5 KB) [[attachment:dispersion_is_there_a_problem_dobson_etal_austjchem54.pdf]]
  • [get | view] (2021-02-16 12:35:45, 95.4 KB) [[attachment:distributeddisp_williams_stone_jcp119.pdf]]
  • [get | view] (2021-02-16 12:48:13, 84.4 KB) [[attachment:min-1-hb1.png]]
  • [get | view] (2021-02-16 13:01:12, 111.1 KB) [[attachment:min-2-s1.png]]
  • [get | view] (2021-02-16 13:02:41, 108.7 KB) [[attachment:min-3-s2.png]]
  • [get | view] (2021-02-16 13:03:49, 87.9 KB) [[attachment:min-4-t1.png]]
  • [get | view] (2021-02-16 12:34:10, 266.2 KB) [[attachment:new_rep_for_dispersion_hodges_stone_molphys98.pdf]]
  • [get | view] (2021-02-16 13:06:00, 13.3 KB) [[attachment:pyr2-all-geoms.geom.gz]]
  • [get | view] (2021-02-16 13:08:43, 0.5 KB) [[attachment:pyr2-damp3-ab-sisa-0.80.disp.gz]]
  • [get | view] (2021-02-16 13:07:03, 50.5 KB) [[attachment:pyr2-saptdft-disp.dat.gz]]
  • [get | view] (2021-02-16 12:58:48, 1.3 KB) [[attachment:pyridine dimer geometry_ Double-H-Bonded]]
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