2016
DOI: 10.1021/acsenergylett.6b00595
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Surface Termination, Morphology, and Bright Photoluminescence of Cesium Lead Halide Perovskite Nanocrystals

Abstract: Colloidal cesium lead halide perovskite nanocrystals (CsPbX3 PNCs, X = Cl, Br, I) exhibit important optoelectronic properties that make them amenable for a plethora of applications. However, the origin of these properties, even for as-synthesized and unpurified PNCs, is largely unknown. Electronic structure calculations are therefore essential to understand with atomistic detail the properties of these nanomaterials; however, finding a model for PNCs that resembles the experiments is a challenging task. Essent… Show more

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Cited by 208 publications
(264 citation statements)
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“…Since the electronic structure calculations are essential to understand with atomistic detail the optoelectronic properties of nanomaterials, [117,118] more efforts should be focused on the theoretical studies related to fully-inorganic perovskites NCs.…”
Section: Electronic Structuresmentioning
confidence: 99%
“…Since the electronic structure calculations are essential to understand with atomistic detail the optoelectronic properties of nanomaterials, [117,118] more efforts should be focused on the theoretical studies related to fully-inorganic perovskites NCs.…”
Section: Electronic Structuresmentioning
confidence: 99%
“…Although lead halide perovskites have a high defect tolerance compared to conventional semiconductor NCs (ie, CdSe, InP), the presence of typical defects such as undesirable cation or anion vacancies tends to cause trapped energy levels that fall within the CB (conduction band) and VB (valence band). This leads to a significant loss in carrier radiative recombination . These defects may deteriorate the short‐range order of the lattice and act as trapping centers of photo‐generated carriers, such as vacancies or distorted [PbX 6 ] octahedra on the surface and inside the perovskite.…”
Section: Component Engineering For Blue‐emissive Perovskitesmentioning
confidence: 99%
“…The presence of chlorine causes a large number of defects in perovskite QDs compared to pure bromine analogues . The cation or anion vacancies tend to trap energy between the CB and VB, resulting in a nonradiative recombination process . The ligand passivation strategy introduced into CsPbBr 3 QDs was reported by Li et al in order to increase PL efficiency.…”
Section: Component Engineering For Blue‐emissive Perovskitesmentioning
confidence: 99%
“…Swarnkar et al first described the formation of α-CsPbI 3 QD films that are phase-stable for months under ambient condition and fabricated perovskite QD solar cells with an open-circuit voltage (V OC ) of 1.23 V and efficiency of 10.77%. [9,46,47] Therefore, further understanding of the ligand exchange process during CsPbI 3 QD solar cell fabrication and improving charge transport between QDs are still very important. [41] In comparison with the thin-film CsPbI 3 solar cells, [36][37][38] the short-circuit current density (J SC ) of CsPbI 3 QD solar cells is still lagging, [40][41][42] which may be attributed to the insufficient charge transport caused by residual of the insulating surface ligands.…”
mentioning
confidence: 99%