Computational aspects of anthocyanidins and anthocyanins: A review
A Sinopoli, G Calogero, A Bartolotta - Food chemistry, 2019 - Elsevier
Anthocyanins and anthocyanidins are polyphenolic compounds, responsible for the red and
blue colours in several fruits, flowers, and leaves. Their colorant properties, bioavailability …
blue colours in several fruits, flowers, and leaves. Their colorant properties, bioavailability …
Insight into D–A− π–A structured sensitizers: a promising route to highly efficient and stable dye-sensitized solar cells
The dye-sensitized solar cell (DSSC) is one of the most promising photovoltaic technologies
with potential of low cost, light weight, and good flexibility. The practical application of …
with potential of low cost, light weight, and good flexibility. The practical application of …
Influence of structural factors on the photovoltaic properties of dye-sensitized solar cells
EA Knyazeva, OA Rakitin - Russian Chemical Reviews, 2016 - iopscience.iop.org
Data on the structure and photovoltaic properties of organic dye-sensitized solar cells
published in the last five years are for the first time collected, systematized and generalized …
published in the last five years are for the first time collected, systematized and generalized …
Influence of internal acceptor and thiophene based π-spacer in DA-π-A system on photophysical and charge transport properties for efficient DSSCs: A DFT insight
A series of DA-π-A organic dyes are taken into consideration to study the influence of
different internal acceptor groups and thiophene based π-spacers on their efficiency in dye …
different internal acceptor groups and thiophene based π-spacers on their efficiency in dye …
Impact of internal (donor/acceptor) moieties and π-spacer in triphenylamine-based dyes for DSSCs
The impact of internal (donor/acceptor) groups and π-spacers (benzene/thiophene) are
investigated in dye-sensitized solar cells (DSSCs) using a series of DA-π-A and DD-π-A …
investigated in dye-sensitized solar cells (DSSCs) using a series of DA-π-A and DD-π-A …
The impact of aromatic π-spacers and internal acceptors in triphenylamine dyes for DSSCs: A DFT approach
In present work, the influence of internal acceptors and π-spacers on optoelectronic
properties for dye-sensitized solar cells (DSSCs) is investigated. The dyes consist of various …
properties for dye-sensitized solar cells (DSSCs) is investigated. The dyes consist of various …
Design and theoretical study of phenothiazine-based low bandgap dye derivatives as sensitizers in molecular photovoltaics
Modulation of metal free organic (MFO) molecules become imperative to researchers to
obtain low-cost sensitizer for dye sensitized solar cells (DSSCs) purposes. A series of metal …
obtain low-cost sensitizer for dye sensitized solar cells (DSSCs) purposes. A series of metal …
Second order hyperpolarizability of triphenylamine based organic sensitizers: a first principle theoretical study
M Prakasam, PM Anbarasan - RSC advances, 2016 - pubs.rsc.org
Designed metal-free dyes have been investigated by Density Functional Theory (DFT) and
Time-Dependent DFT (TD-DFT) to evaluate the ground state and excited state geometries of …
Time-Dependent DFT (TD-DFT) to evaluate the ground state and excited state geometries of …
Computational investigations on efficient metal-free organic D-π-A dyes with different spacers for powerful DSSCs applications
PM Anbarasan, A Arunkumar, M Shkir - Molecular Simulation, 2022 - Taylor & Francis
ABSTRACT Based on 3-(4-((4-carbazol-9-yl-phenyl) ethynyl) phenyl)-2-cyanoacrylic acid
(CB1) dye, the six newly planned organic spacer (CBS1-CBS6) dyes were investigated for …
(CB1) dye, the six newly planned organic spacer (CBS1-CBS6) dyes were investigated for …
Screening donor groups of organic dyes for dye-sensitized solar cells
Based on an experimentally synthesized dye D5 (also named d01 in this work), we
designed and screened a series of dyes d02–d06 with different electron donors, such as …
designed and screened a series of dyes d02–d06 with different electron donors, such as …