A DFT study on 1, 4-dihydro-1, 4-azaborinine annulated linear polyacenes: Absorption spectra, singlet-triplet energy gap, aromaticity, and HOMO-LUMO energy modulation

Ramachandran Rakhi, Cherumuttathu H. Suresh. A DFT study on 1, 4-dihydro-1, 4-azaborinine annulated linear polyacenes: Absorption spectra, singlet-triplet energy gap, aromaticity, and HOMO-LUMO energy modulation. Journal of Computational Chemistry, 38(26):2232-2240, 2017. [doi]

@article{RakhiS17,
  title = {A DFT study on 1, 4-dihydro-1, 4-azaborinine annulated linear polyacenes: Absorption spectra, singlet-triplet energy gap, aromaticity, and HOMO-LUMO energy modulation},
  author = {Ramachandran Rakhi and Cherumuttathu H. Suresh},
  year = {2017},
  doi = {10.1002/jcc.24868},
  url = {https://doi.org/10.1002/jcc.24868},
  researchr = {https://researchr.org/publication/RakhiS17},
  cites = {0},
  citedby = {0},
  journal = {Journal of Computational Chemistry},
  volume = {38},
  number = {26},
  pages = {2232-2240},
}