Projects per year
How strong is the H⋅⋅⋅H bond in solid BH3NH3? Insight from periodic density functional calculations predicts an average value of 12.7 kJ mol−1, reassigning the interaction towards the lower end of the dihydrogen bond strength spectrum.
|Journal||Angewandte Chemie International Edition|
|Publication status||Published - 7 Sep 2004|
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- 1 Finished
The application of new computational methods in chemistry
1/10/00 → 31/03/07