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New organic dye-sensitized solar cells based on the D–A–π–A structure for efficient DSSCs: DFT/TD-DFT investigations
Global energy consumption has increased due to population growth and economic
development. Solar energy is one of the most important renewable energy sources for …
development. Solar energy is one of the most important renewable energy sources for …
Environmentally compatible and highly improved hole transport materials (HTMs) based on benzotrithiophene (BTT) skeleton for perovskite as well as narrow …
S Zahid, A Rasool, M Ans, MS Akhter, J Iqbal… - Solar Energy, 2022 - Elsevier
This research project centralized modeling and DFT analysis of reference (BTTR) and
intended chromophores (BTTM1-BTTM5) based on benzotrithiophene (BTT) core to render …
intended chromophores (BTTM1-BTTM5) based on benzotrithiophene (BTT) core to render …
Bithieno thiophene-based small molecules for application as donor materials for organic solar cells and hole transport materials for perovskite solar cells
This quantum mechanical study focuses on the designing of twelve (MPAM1–MPAM12)
bithieno thiophene (BTTI) central core-based small molecules to explore optoelectronic …
bithieno thiophene (BTTI) central core-based small molecules to explore optoelectronic …
The evolution of small molecular acceptors for organic solar cells: Advances, challenges and prospects
X Liang, J Wang, R Miao, Q Zhao, L Huang, S Wen… - Dyes and …, 2022 - Elsevier
Organic solar cells (OSCs) have attracted lots of research attention and significant
developments have been achieved in the last decade. Small molecular acceptors (SMAs) …
developments have been achieved in the last decade. Small molecular acceptors (SMAs) …
Synergistic engineering of end-capped acceptor and bridge on arylborane-arylamine macrocycles to boost the photovoltaic properties of organic solar cells
A new stream of donor-π-acceptor (D-π-A) type arylborane-arylamine based donor
contributors namely (BN1, BN2, BN3, BN4, BN5) have been drafted by substituting the …
contributors namely (BN1, BN2, BN3, BN4, BN5) have been drafted by substituting the …
Boosting the performance of diketopyrrolopyrrole-triphenylamine-based organic solar cells via π-linker engineering
The design and development of novel and efficient donor–π–acceptor (D–π–A) type
conjugated systems has attracted substantial interest in the field of organic electronics owing …
conjugated systems has attracted substantial interest in the field of organic electronics owing …
Engineering of the central core on DBD-based materials with improved power-conversion efficiency by using the DFT approach
Develo** proficient organic solar cells with improved optoelectronic properties is still a
matter of concern. In the current study, with an aspiration to boost the optoelectronic …
matter of concern. In the current study, with an aspiration to boost the optoelectronic …
Benzocarbazole-based D–Di–π–A dyes for DSSCs: DFT/TD-DFT study of influence of auxiliary donors on the performance of free dye and dye–TiO2 interface
A series of ten organic dyes Ai (i= 1–10) of type D–Di–π–A (i= 2–10) combining various
auxiliary donors (Di) with the same donor group (benzocarbazole), π-spacer (thiophene) …
auxiliary donors (Di) with the same donor group (benzocarbazole), π-spacer (thiophene) …
New non-fullerene electron acceptors-based on quinoxaline derivatives for organic photovoltaic cells: DFT computational study
In this work, we develop a new non-fullerene electron acceptor for organic photovoltaic cells.
Precisely, we present a computational study of new engineered molecules-based …
Precisely, we present a computational study of new engineered molecules-based …
Effects of electron acceptor groups on triphenylamine-based dyes for dye-sensitized solar cells: Theoretical investigation
Six novel D-π-A organic dyes based on 3D triphenylamine derivative (IDTTPA) featuring
indenothiophene unit have been designed and theoretically investigated using Density …
indenothiophene unit have been designed and theoretically investigated using Density …