DFT studies on hexaborate(2-) and heptaborate(2-) anions
Research output: Contribution to journal › Article › peer-review
Electronic versions
Bond counting rules (BCR) allow chemists to unearth low-energy structures by sequentially sieving undesirable interactions whilst maximizing stabilizing interactions. The approach is applied to model hydrogen-bonding in polyborate anions.
Keywords
- Polyborate anions, hydrogen bonding, DFT, Hexoborate, Heptaborate
| Original language | English |
|---|---|
| Pages (from-to) | 633-637 |
| Journal | Phosphorus, Sulfur and Silicon and the Related Elements |
| Volume | 191 |
| Issue number | 4 |
| Early online date | 18 Feb 2016 |
| DOIs | |
| Publication status | Published - 1 Apr 2016 |
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