Unraveling Oxygen Vacancies Effect on Chemical Composition, Electronic Structure and Optical Properties of Eu Doped SnO.

The influence of Eu doping (0.5, 1 and 2 mol.%) and annealing in an oxygen-deficient atmosphere on the structure and optical properties of SnO nanoparticles were investigated in relation to electronic structure.

Fine Purification Engineering Enables Efficient Perovskite QLEDs with Efficiency Exceeding 23.

Perovskite quantum dots (PeQDs) have great application prospects in fields such as displays and solar cells due to their adjustable band gap, high absorption coefficient, high carrier mobility, and solution processability. However, the ionic crystal characteristic of PeQDs and their surface ligands have led to problems such as solvent sensitivity, poor crystal stability, and difficulty in adjusting the photoelectric properties, which are challenges in high-quality PeQDs. Here, to solve the problem of fluorescence degradation caused by phase change and loss of surface ligands during the purification process of CsPbI QDs, this work develops a purification strategy that finely regulates the polarity of the purification solvent, to obtain high-purity perovskite.

Enhancing Photostability of Complex Lead Halides through Modification with Antibacterial Drug Octenidine.

The high power-conversion efficiencies of hybrid perovskite solar cells encourage many researchers. However, their limited photostability represents a serious obstacle to the commercialization of this promising technology. Herein, we present an efficient method for improving the intrinsic photostability of a series of commonly used perovskite material formulations such as MAPbI, FAPbI, CsFAPbI, and CsMAFAPbI through modification with octenidine dihydroiodide (), which is a widely used antibacterial drug with two substituted pyridyl groups and two cationic centers in its molecular framework.

Proton Irradiation on Halide Perovskites: Numerical Calculations.

The results of numerical SRIM and SCAPS calculations for the ionization, displacement and heating of hybrid perovskites under the influence of protons (E = 0.15, 3.0 and 18 MeV) are presented and show that the lowest transfer energy is demonstrated by the MAPbI, FAPbBr and FAPbI compounds, which represent the greatest potential for use as solar cells in space devices.

Anthraquinone-Quinizarin Copolymer as a Promising Electrode Material for High-Performance Lithium and Potassium Batteries.

The growing demand for cheap, safe, recyclable, and environmentally friendly batteries highlights the importance of the development of organic electrode materials. Here, we present a novel redox-active polymer comprising a polyaniline-type conjugated backbone and quinizarin and anthraquinone units. The synthesized polymer was explored as a cathode material for batteries, and it delivered promising performance characteristics in both lithium and potassium cells.

Molecular Structure-Intrinsic Photostability Relationships for a Series of Conjugated Polymers: Backbone Substitution Matters!

Herein, we present an efficient approach for screening the intrinsic photostability of organic absorber materials used in photovoltaic applications. Using a series of structurally related conjugated polymers and a set of complementary techniques, we established important "material structure-photostability" relationships. In particular, we have revealed that the introduction of alkoxy, thioalkyl, and fluorine substituents adversely affects the material photostability.

Realizing High Brightness Quasi-2D Perovskite Light-Emitting Diodes with Reduced Efficiency Roll-Off via Multifunctional Interface Engineering.

Quasi-2D perovskites have recently flourished in the field of luminescence due to the quantum-confinement effect and the efficient energy transfer between different n phases resulting in exceptional optical properties. However, owing to the lower conductivity and poor charge injection, quasi-2D perovskite light-emitting diodes (PeLEDs) typically suffer from low brightness and high-efficiency roll-off at high current densities compared to 3D perovskite-based PeLEDs, which is undoubtedly one of the most critical issues in this field. In this work, quasi-2D PeLEDs with high brightness, reduced trap density, and low-efficiency roll-off are successfully demonstrated by introducing a thin layer of conductive phosphine oxide at the perovskite/electron transport layer interface.

The Stability of Hybrid Perovskites with UiO-66 Metal-Organic Framework Additives with Heat, Light, and Humidity.

This study is devoted to investigating the stability of metal-organic framework (MOF)-hybrid perovskites consisting of CHNHPbI (MAPbI) and UiO-66 without a functional group and UiO-66 with different COOH, NH,and F functional groups under external influences including heat, light, and humidity. By conducting crystallinity, optical, and X-ray photoelectron spectra (XPS) measurements after long-term aging, all of the prepared MAPbI3@UiO-66 nanocomposites (with pristine UiO-66 or UiO-66 with additional functional groups) were stable to light soaking and a relative humidity (RH) of 50%. Moreover, the UiO-66 and UiO-66-(F) hybrid perovskite films possessed a higher heat tolerance than the other two UiO-66 with the additional functional groups of NH and COOH.

Synthesis of Nanocomposite TiSiCN Coatings by Titanium Evaporation and Organosilicon Compound Activation in Hollow Cathode Arc Discharge.

TiSiCN coatings have been obtained by anode evaporation of titanium and the decomposition of hexamethyldisilazane in an arc discharge, using a self-heated hollow cathode, at the pressure rate of 1 mTorr of the Ar+N gas mixture. The proposed method makes it possible to independently and widely change the amount of metal and precursor vapor flows, the pressure and composition of the vapor-gas mixture and the degree of ionic interaction on the surface of the growing coating within a single discharge system. The paper presents the method and the results of the effect of a current discharge (10-50 A), and the flux of precursor vapours (0-1 g/h), on deposition rates, compositions, and properties of TiSiCN coatings deposited by an advanced combined PVD+PECVD method.

Nanoscale Visualization of Photodegradation Dynamics of MAPbI Perovskite Films.

Herein, we report the nanoscale visualization of the photochemical degradation dynamics of MAPbI (MA = CHNH) using infrared scattering scanning near-field microscopy (IR s-SNOM) combined with a series of complementary analytical techniques such as UV-vis and FTIR-spectroscopy, XRD, and XPS. Light exposure of the MAPbI films resulted in a gradual loss of MA cations starting from the grain boundaries at the film surface and slowly progressing toward the center of the grains and deeper into the bulk perovskite phase. The binary lead iodide PbI was found to be the major perovskite photochemical degradation product under the experimental conditions used.

Interfacial "Anchoring Effect" Enables Efficient Large-Area Sky-Blue Perovskite Light-Emitting Diodes.

While tremendous progress has recently been made in perovskite light-emitting diodes (PeLEDs), large-area blue devices feature inferior performance due to uneven morphologies and vast defects in the solution-processed perovskite films. To alleviate these issues, a facile and reliable interface engineering scheme is reported for manipulating the crystallization of perovskite films enabled by a multifunctional molecule 2-amino-1,3-propanediol (APDO)-triggered "anchoring effect" at the grain-growth interface. Sky-blue perovskite films with large-area uniformity and low trap states are obtained, showing the distinctly improved radiative recombination and hole-transport capability.

Temperature Dynamics of MAPbI and PbI Photolysis: Revealing the Interplay between Light and Heat, Two Enemies of Perovskite Photovoltaics.

Regardless of the impressive photovoltaic performances demonstrated for lead halide perovskite solar cells, their practical implementation is severely impeded by the low device stability. Complex lead halides are sensitive to both light and heat, which are unavoidable under realistic solar cell operational conditions. Suppressing these intrinsic degradation pathways requires a thorough understanding of their mechanistic aspects.

Unraveling the Impact of Hole Transport Materials on Photostability of Perovskite Films and p-i-n Solar Cells.

We investigated the impact of a series of hole transport layer (HTL) materials such as Poly(3,4-ethylenedioxythiophene) polystyrene sulfonate (PEDOT:PSS), NiO, poly[bis(4-phenyl)(2,4,6-trimethylphenyl)amine (PTAA), and polytriarylamine (PTA) on photostability of thin films and solar cells based on MAPbI, CsFAPbI, CsMAFAPbI, CsMAFAPb(BrI), and CsFAPb(BrI) complex lead halides. Mixed halide perovskites showed reduced photostability in comparison with similar iodide-only compositions. In particular, we observed light-induced recrystallization of all perovskite films except MAPbI with the strongest effects revealed for Br-containing systems.

Unravelling the Material Composition Effects on the Gamma Ray Stability of Lead Halide Perovskite Solar Cells: MAPbI Breaks the Records.

In this work, we report a comparative study of the gamma ray stability of perovskite solar cells based on a series of perovskite absorbers including MAPbI (MA = methylammonium), MAPbBr, CsFAPbI (FA = formamidinim), CsMAFAPbI, CsPbI, and CsPbBr We reveal that the composition of the perovskite material strongly affects the radiation stability of the solar cells. In particular, solar cells based on the MAPbI were found to be the most resistant to gamma rays since this perovskite undergoes rapid self-healing due to the special gas-phase chemistry analyzed with calculations. The fact that the solar cells based on MAPbI can withstand a 1000 kRad gamma ray dose without any noticeable degradation of the photovoltaic properties is particularly exciting and shifts the paradigm of research in this field toward designing more dynamic rather than intrinsically robust (e.

A nickel coordination polymer derived from 1,2,4,5-tetraaminobenzene for fast and stable potassium battery anodes.

We report the application of a Ni-based coordination polymer derived from 1,2,4,5-tetraaminobenzene (P1) as a fast and stable potassium battery anode. In a voltage range of 0.5-2.

Thermal Effects and Halide Mixing of Hybrid Perovskites: MD and XPS Studies.

Thermal effects in organo-metal halide perovskites are studied by ab initio molecular dynamics (MD) simulations performed at effective temperatures of 293 and 383 K and by X-ray photoelectron spectroscopy (XPS). We find that the cause of thermal instability in this class of perovskites is the rotation of the methylammonium (MA) groups that destroy the rigid lattice of pure compounds (MAPbI and MAPbBr). When the Pb-I lattice is initially distorted by partial replacement of the I with Cl or Br, this not only prevents formation of PbI seeds but also improves lattice flexibility and stability against the temperature-induced motion and rotation of MA groups.

XPS evidence of degradation mechanism in CHNHPbI hybrid perovskite.

In this study, we investigate the photo-/thermal degradation mechanism of hybrid perovskites by using x-ray photoelectron (XPS) valence band (VB) spectra coupling with density functional theory (DFT) calculations. Herein, CHNHPbI is respectively subjected to irradiation with visible light and annealing at an exposure of 0-1000 h. It is found from XPS survey spectra that, in both cases (irradiation and annealing), a decrease in the I:Pb ratio is observed with aging time, which unambiguously indicates the formation of PbI as the product of photo/thermal degradation.

γ-Ray-Induced Degradation in the Triple-Cation Perovskite Solar Cells.

We report on the impact of γ radiation (0-500 Gy) on triple-cation CsMAFAPb(BrI) perovskite solar cells. A set of experiments was designed to reveal the individual contributions of the hole-collecting bottom electrode, perovskite absorber, and electron transport layer (ETL) to the overall solar cell degradation under radiation exposure. We show that the glass/ITO/PEDOT:PSS hole-collecting electrode withstands a 500 Gy dose without any losses in the solar cell performance.

Probing the Intrinsic Thermal and Photochemical Stability of Hybrid and Inorganic Lead Halide Perovskites.

We report a careful and systematic study of thermal and photochemical degradation of a series of complex haloplumbates APbX (X = I, Br) with hybrid organic (A = CHNH) and inorganic (A = Cs) cations under anoxic conditions (i.e., without exposure to oxygen and moisture by testing in an inert glovebox environment).

Linking the HOMO-LUMO gap to torsional disorder in P3HT/PCBM blends.

The electronic structure of [6,6]-phenyl C61 butyric acid methyl ester (PCBM), poly(3-hexylthiophene) (P3HT), and P3HT/PCBM blends is studied using soft X-ray emission and absorption spectroscopy and density functional theory calculations. We find that annealing reduces the HOMO-LUMO gap of P3HT and P3HT/PCBM blends, whereas annealing has little effect on the HOMO-LUMO gap of PCBM. We propose a model connecting torsional disorder in a P3HT polymer to the HOMO-LUMO gap, which suggests that annealing helps to decrease the torsional disorder in the P3HT polymers.