Graphyne: Optical Excitations and Charge Distributions
Research output: Contribution to journal › Journal article › Research › peer-review
Graphyne is the new wonder material and the optical transitions and charge distributions of different graphyne fragmewnts are investigated using density functional theory calculations.
| Original language | English |
|---|---|
| Journal | J. Comp. Chem. Mol. Mod. |
| Volume | 6 |
| Issue number | 1 |
| Pages (from-to) | 663-676 |
| Number of pages | 12 |
| DOIs | |
| Publication status | Published - 2023 |
ID: 383027984