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Journal ArticleDOI

Inactive (PbI2)2RbCl stabilizes perovskite films for efficient solar cells

TLDR
Zhao et al. as discussed by the authors converted PbI2 into an inactive (PbI 2 )2RbCl compound by RbCl doping, which effectively stabilizes the perovskite phase.
Abstract
In halide perovskite solar cells the formation of secondary-phase excess lead iodide (PbI2) has some positive effects on power conversion efficiency (PCE) but can be detrimental to device stability and lead to large hysteresis effects in voltage sweeps. We converted PbI2 into an inactive (PbI2)2RbCl compound by RbCl doping, which effectively stabilizes the perovskite phase. We obtained a certified PCE of 25.6% for FAPbI3 (FA, formamidinium) perovskite solar cells on the basis of this strategy. Devices retained 96% of their original PCE values after 1000 hours of shelf storage and 80% after 500 hours of thermal stability testing at 85°C. Description Managing excess lead iodide In hybrid perovskite solar cells, the formation of lead iodide (PbI2) can provide some passivation effects but can lead to device instability and hysteresis in current–density changes with voltage. Zhao et al. show that doping with rubidium chloride (RbCl) can create a passive inactive (PbI2)2RbCl phase that stabilizes the perovskite phase and lowers its bandgap. Devices exhibited 25.6% certified power efficiency and maintained 80% of that efficiency after 500 hours of operation at 85°C. —PDS Converting PbI2 into inactive (PbI2)2RbCl by RbCl doping can stabilize the perovskite phase and increase efficiency.

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Rational design of Lewis base molecules for stable and efficient inverted perovskite solar cells

TL;DR: Li et al. as mentioned in this paper used density functional theory to screen potential Lewis bases and found that phosphorus-containing molecules showed the strongest binding to lead, and the best inverted PSC treated with 1,3-bis(diphenylphosphino)propane (DPPP), a diphosphine Lewis base that passivates, binds, and bridges interfaces and grain boundaries, retained a power conversion efficiency slightly higher than its initial PCE of ~23% after continuous operation under simulated AM1.5 illumination at the maximum power point and at ~40°C for >
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Compositional texture engineering for highly stable wide-bandgap perovskite solar cells

TL;DR: In this article , a columnar 1.75-electron volt WBG perovskite mixture was used to achieve state-of-the-art performance with a high voltage of 2.2 volts.
Journal ArticleDOI

Molecular Doping of Flexible Lead-Free Perovskite-Polymer Thick Membranes for High-Performance X-Ray Detection.

TL;DR: In this article , a low-toxicity, flexible X-ray detector based on p-type doped MA3Bi2I9 (MA = methylammonium) perovskite-filled membranes (PFMs) was presented.
References
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Journal ArticleDOI

Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set.

TL;DR: An efficient scheme for calculating the Kohn-Sham ground state of metallic systems using pseudopotentials and a plane-wave basis set is presented and the application of Pulay's DIIS method to the iterative diagonalization of large matrices will be discussed.
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Special points for brillouin-zone integrations

TL;DR: In this article, a method for generating sets of special points in the Brillouin zone which provides an efficient means of integrating periodic functions of the wave vector is given, where the integration can be over the entire zone or over specified portions thereof.
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Self-Consistent Equations Including Exchange and Correlation Effects

TL;DR: In this paper, the Hartree and Hartree-Fock equations are applied to a uniform electron gas, where the exchange and correlation portions of the chemical potential of the gas are used as additional effective potentials.
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VESTA 3 for three-dimensional visualization of crystal, volumetric and morphology data

TL;DR: VESTA has been upgraded to the latest version, VESTA 3, implementing new features including drawing the external mor­phology of crystals, and an extended bond-search algorithm to enable more sophisticated searches in complex molecules and cage-like structures.
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Ground state of the electron gas by a stochastic method

TL;DR: An exact stochastic simulation of the Schroedinger equation for charged Bosons and Fermions was used to calculate the correlation energies, to locate the transitions to their respective crystal phases at zero temperature within 10%, and to establish the stability at intermediate densities of a ferromagnetic fluid of electrons.
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