RSC Advances
Charge transfer articles published in the last
6 months
Synthesis, characterization, crystal structure, and fabrication of photosensitive Schottky device of a binuclear Cu(II)-Salen complex: a DFT investigations
This work explores one centrosymmetric binuclear Cu(II)-Salen complex synthesis, characterization, photosensitive Schottky barrier diode (PSBD) function, and DFT spectrum.
RSC Adv., 2024,14, 14992-15007
https://doi.org/10.1039/D4RA01846J
An in situ phase transformation induced mesoporous heterointerface for the alkaline hydrogen evolution reaction
In situ phase transformation is achieved from single-phase Co3O4 to CoO/CoP hybrid phases, which acts as a highly efficient electrocatalyst for the hydrogen evolution reaction.
RSC Adv., 2024,14, 14886-14893
https://doi.org/10.1039/D4RA02063D
Understanding charge transport and dielectric relaxation properties in lead-free Cs2ZrCl6 nanoparticles
In the exploration of perovskite materials devoid of lead and appropriate for capturing solar energy, a recent finding has surfaced concerning Cs2ZrCl6.
RSC Adv., 2024,14, 14221-14232
https://doi.org/10.1039/D4RA02031F
Electric-field modulated energy transfer in phosphorescent material- and fluorescent material-codoped polymer light-emitting diodes
In this study, we find electric-field modulated energy transfer in phosphorescent material- and fluorescent material-codoped polymer that has never been reported.
RSC Adv., 2024,14, 12294-12302
https://doi.org/10.1039/D4RA00669K
An examination of the effectiveness of the expired drug isoprinosine in preventing aluminum corrosion in alkaline solutions using both computational and experimental techniques
A now-expired medication called isoprinosine was examined in NaOH (0.50 M) solutions as a potential novel inhibitor of aluminum corrosion.
RSC Adv., 2024,14, 11244-11257
https://doi.org/10.1039/D4RA00158C
In silico modelling of chelate stabilized tetrylene derivatives
The steric and electronic effects of specific ligands can play crucial roles in stabilizing unsaturated tetrylene species.
RSC Adv., 2024,14, 10161-10171
https://doi.org/10.1039/D4RA01515K
Structural, morphological, electrical, and dielectric properties of Na2Cu5(Si2O7)2 for ASSIBs
Solid inorganic electrolyte materials are fundamental components for constructing all-solid-state sodium-ion batteries.
RSC Adv., 2024,14, 9228-9242
https://doi.org/10.1039/D4RA01454E
Systematic surface bowing in 2D III-nitride monolayers
This work reports systematic surface bowing in the 2D structure of III-nitrides due to the C60 adsorption as we proceed from BN → AlN → GaN → InN.
RSC Adv., 2024,14, 8896-8904
https://doi.org/10.1039/D4RA01310G
Synergism in carbon nanotubes and carbon-dots: counter electrode of a high-performance dye-sensitized solar cell
This study paves the way of tailoring property of counter electrode with carbon nanomaterials in dye-sensitized solar cell.
RSC Adv., 2024,14, 7616-7630
https://doi.org/10.1039/D4RA00601A
Pioneering dielectric materials of Sn-doped Nb0.025Ti0.975O2 ceramics with excellent temperature and humidity stability for advanced ceramic capacitors
The dielectric properties exhibit excellent stability across a wide range of temperatures. Additionally, the capacitance is almost exclusively dependent on humidity levels.
RSC Adv., 2024,14, 7631-7639
https://doi.org/10.1039/D3RA08336E
Concentration dependence of resistance components in solutions containing dissolved Fe2+/Fe3+
The concentration (c) dependence of solution (Rs) and diffusion (Rdif) resistances of solutions containing dissolved Fe2+/Fe3+ is well reproduced by their viscosity η(c) at c.
RSC Adv., 2024,14, 6292-6297
https://doi.org/10.1039/D3RA07829A
Solvatochromism of new tetraphenylethene luminogens: integration of aggregation-induced emission and conjugation-induced rigidity for emitting strongly in both solid and solution state
We synthesized and characterized TPE analogs, revealing AIE and solvatochromism. Quantum calculations confirmed diverse behavior due to molecular packing and rigidity. The compounds showed biocompatibility, suggesting potential for cell imaging.
RSC Adv., 2024,14, 6072-6084
https://doi.org/10.1039/D4RA00719K
Intrinsic dynamic and static natures of APn--X+--BPn σ(3c–4e) type interactions (APn = BPn = N, P, As and Sb; X = H, F, Cl, Br and I) in bicyclo[3.3.3] and bicyclo[4.4.4] systems and their behaviour, elucidated with QTAIM dual functional analysis
Natures of the symmetric and nonsymmetric Pn⋯X+⋯Pn σ(3c–4e) type interactions (Pn = N, P, As and Sb; X = H, F, Cl, Br and I) in bicyclo[3.3.3] and [4.4.4] systems are elucidated, after clarifying the stability, where X+ incorporated in the cage.
RSC Adv., 2024,14, 5675-5689
https://doi.org/10.1039/D3RA08926F
Electron-donating arene-substituted pentacenedione derivatives: a study of structural, electronic, and electrochemical properties
A new series of redox-active tetraryl-substituted pentacenedione derivatives, namely Ar4-PDs, was prepared through Suzuki–Miyaura coupling reactions between a bis(dibromomethane)pentacenedione and various arene boronic acids.
RSC Adv., 2024,14, 5331-5339
https://doi.org/10.1039/D3RA05173K
Exploring the potential of end-capping acceptor engineering on indolo[3,2-b]indole-based small molecules for efficient organic and perovskite solar cells
Photovoltaic (PV) materials, especially organic and perovskite solar cells are effective candidates for meeting the rising global energy demand.
RSC Adv., 2024,14, 5248-5263
https://doi.org/10.1039/D3RA08639A
A DFT study of bandgap tuning in chloro-fluoro silicene
The structural, electronic and optical properties of silicene and its derivatives are investigated in the present work by employing density functional theory.
RSC Adv., 2024,14, 4844-4852
https://doi.org/10.1039/D3RA07452H
Investigation of conduction mechanisms and permittivity–conductivity correlation in a Gd-based perovskite structure
Currently, the development of perovskites has required a lot of attention for fundamental investigation and electronic devices
RSC Adv., 2024,14, 4142-4152
https://doi.org/10.1039/D3RA08703D
Recent advances in single-atom alloys: preparation methods and applications in heterogeneous catalysis
Single-atom alloys (SAAs) are a different type of alloy where a guest metal, usually a noble metal (e.g., Pt, Pd, and Ru), is atomically dispersed on a relatively more inert (e.g., Ag and Cu) host metal.
RSC Adv., 2024,14, 3936-3951
https://doi.org/10.1039/D3RA07029H
Construction of Z-scheme AgCl/BiOCl heterojunction with oxygen vacancies for improved pollutant degradation and bacterial inactivation
A facile Z-scheme AgCl/BiOCl heterojunction photocatalyst with oxygen vacancies was fabricated by a water-bath method.
RSC Adv., 2024,14, 3888-3899
https://doi.org/10.1039/D3RA08514G
2D-Graph of intermolecular interactions predicts radical character of anion–π* type charge-transfer complexes
An alternative description of bimolecular interactions in organic chemistry is proposed, where the overlap integral (SDA) and energy gap (EDA) between donor HOMO and acceptor LUMO are used as two axes in the 2D map.
RSC Adv., 2024,14, 3771-3775
https://doi.org/10.1039/D3RA07729B
Investigation of the structural, surface topographical, fractal, capacitive, and electrical properties of a defect brownmillerite perovskite material KBiFeMnO5 for electronic devices
This article reports the development and characterizations (structural, surface topographical, fractal, dielectric, transport, impedance, resistive, and current–voltage properties) of a defect brownmillerite material KBiFeMnO5.
RSC Adv., 2024,14, 3400-3412
https://doi.org/10.1039/D3RA08106K
Exploring the effect of boron on the grain morphology change and spectral properties of Eu3+ activated barium tantalate phosphor
The effect of the grain morphology on the photoluminescence, charge transfer band, and decay properties was investigated by xEu3+, yB3+ (x = 10 mol%, y = 0, 5, 15, 30, 50, 70, and 100 mol%) co-doped BaTa2O6 ceramics fabricated by solid-state reaction.
RSC Adv., 2024,14, 2687-2696
https://doi.org/10.1039/D3RA08197D
Morphological, structural, optical and dielectric analysis of Cs2TiBr6 perovskite nanoparticles
In the pursuit of lead-free perovskite materials suitable for harnessing solar energy, a recent discovery has emerged regarding Cs2TiBr6.
RSC Adv., 2024,14, 1634-1648
https://doi.org/10.1039/D3RA06860A
Toxic gas sensing performance of arsenene functionalized by single atoms (Ag, Au): a DFT study
Ag/Au dopants in arsenene can enhance the sensitivity and selectivity of detecting H2S, SO2, CO, NH3, NO and NO2 with good reusability at different temperatures.
RSC Adv., 2024,14, 1445-1458
https://doi.org/10.1039/D3RA07816G
Influence of acceptors on the optical nonlinearity of 5H-4-oxa-1,6,9-trithia-cyclopenta[b]-as-indacene-based chromophores with a push–pull assembly: a DFT approach
Herein, a series of compounds (TPD1–TPD6) having a D–π–A architecture was quantum chemically designed via the structural modulation of TPR.
RSC Adv., 2024,14, 1169-1185
https://doi.org/10.1039/D3RA06673H
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