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    Methylammonium tin iodide perovskite: structural, electronic and thermodynamic properties by a DFT study with different exchange–correlation functionals 

    Paschal, Catherine; Pogrebnoi, Alexander M.; Pogrebnaya, Tatiana P.; Seriani, Nicola (Springer Nature Switzerland AG., 2020-03-20)
    Lead-free perovskites have drawn much attention of researchers in the field of electronics and photovoltaics due to the toxicity issue of the lead halide perovskites. The methylammonium tin iodide CH3NH3SnI3 amongst others ...
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    Investigation of optoelectronic properties of triphenylamine-based dyes featuring heterocyclic anchoring groups for DSSCs’ applications: a theoretical study 

    Deogratias, Geradius; Al-Qurashi, Ohoud S.; Wazzan, Nuha; Seriani, Nicola; Pogrebnaya, Tatiana P.; Pogrebnoi, Alexander M. (Springer Nature Switzerland AG., 2020-08-05)
    Design and synthesis of new potent sensitizers are of interest for realization of high-efficiency Dye Sensitized Solar Cells (DSSCs). Modification of the triphenylamine-based dyes by introducing suitable anchoring groups ...

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    Author
    Pogrebnaya, Tatiana P. (2)
    Pogrebnoi, Alexander M. (2)
    Seriani, Nicola (2)
    Al-Qurashi, Ohoud S. (1)Deogratias, Geradius (1)Paschal, Catherine (1)Wazzan, Nuha (1)SubjectAnchoring groups (1)Enthalpy of formation (1)Quantum ESPRESSO (1)TD-DFT; Heterocyclic (1)Tin perovskite (1)TPA-based sensitizers (1)... View MoreDate Issued2020 (2)Has File(s)Yes (2)

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