International Journal of Scientific and Research Publications

IJSRP, Volume 11, Issue 3, March 2021 Edition [ISSN 2250-3153]


TD-DFT study of small organic molecules based on Boron subphthalocyanines by modifying axial substituents for organic photovoltaics
      Faheem Abbas, Tayyaba Nasir, Muhammad Awais Ahmad, Saira Sehar, Rida Zulfiqar, Muhammad Shaid Iqbal, Muhammad Ishaq
Abstract: To boost the performance of solar cells (SCs), four non-fullerene ?-conjugated acceptor compounds, including iodo-substituted (SubPcs) subphthalocyanines is ?-conjugated rigid tetrahedral geometry aromatic molecule composed of three units combined around a boron atom bearing a macrocycle core with a perpendicular axial ligand. The C3 designed molecule shows the optoelectronic analysis is better than the reference molecule R due to absorption range because its range found to be nearer the reference compound as well as the absorption occur at 645.53 nm, 519 nm respectively.

Reference this Research Paper (copy & paste below code):

Faheem Abbas, Tayyaba Nasir, Muhammad Awais Ahmad, Saira Sehar, Rida Zulfiqar, Muhammad Shaid Iqbal, Muhammad Ishaq (2021); TD-DFT study of small organic molecules based on Boron subphthalocyanines by modifying axial substituents for organic photovoltaics; International Journal of Scientific and Research Publications (IJSRP) 11(3) (ISSN: 2250-3153), DOI: http://dx.doi.org/10.29322/IJSRP.11.03.2021.p11151
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