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- Ab initio calculations 12
- Actinides 1
- ADF 3
- Borates 27
- Boron 77
- C82 14
- Cations 8
- Computational chemistry 50
- Dehydrogenation 11
- DFT 3
- Dienes 27
- Dimer 21
- Electrochemistry 4
- Epoxidation 46
- Fullerenes 77
- fullerenes 14
- Geometry optimization 4
- gold surface 12
- Homogeneous catalysis 50
- Hydroboration 27