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- Hubbard 2127
- Huisgen reaction 28
- Hybrid functionals, Prussian blue, Magnetic structures, Metal cyanides 27
- Hydrogen 966
- Hydrogen evolution 1065
- Hydrogen Evolution Reaction 33
- Hydrogen production 9
- Hydrogen transfer 142
- Hydrogenation 578
- hydrogenation 12
- Hydrolytic Dehydrogenation 68
- Imidazolium 54
- Imine Condensation 294
- imine condensation 38
- Implicit solvation 693
- implicit solvation 38
- implicit solvent 398
- Indium 102
- indole 100
- Indole functionalization 53