2022
DOI: 10.1021/jacs.1c09235
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Bulk Superlattice Analogues for Energy Conversion

Abstract: Energy storage and conversion in a clean, efficient, and safe way is the core appeal of a modern sustainable society, which is built on the development of multifunctional materials. Superlattice structures can integrate the advantage of their sublayers while new phenomena may arise from the interface, which play key roles in modern semiconductor technology; however, additional concerns such as stability and yield challenge their large-scale applications in industrial products. In this Perspective we focus our … Show more

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Cited by 15 publications
(13 citation statements)
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“…To simplify the simulation process, only two theoretical crystal structures with different thickness (L-and S-ZnO) have been built, which includes hexagonal zinc oxide with supercells of 5 Â 3 Â 1 (for L-ZnO) and 2 Â 3 Â 1 (for S-ZnO), respectively. [28][29][30] As illustrated in Fig. 3a-c To analyze the above results from an electronic perspective, we have calculated the density of states (DOS) as well as the differential charge density for L-and S-ZnO adsorbed by *OOH intermediates.…”
Section: Resultsmentioning
confidence: 99%
“…To simplify the simulation process, only two theoretical crystal structures with different thickness (L-and S-ZnO) have been built, which includes hexagonal zinc oxide with supercells of 5 Â 3 Â 1 (for L-ZnO) and 2 Â 3 Â 1 (for S-ZnO), respectively. [28][29][30] As illustrated in Fig. 3a-c To analyze the above results from an electronic perspective, we have calculated the density of states (DOS) as well as the differential charge density for L-and S-ZnO adsorbed by *OOH intermediates.…”
Section: Resultsmentioning
confidence: 99%
“…From the molecular point of view, the activity of chemical reactions originates from the weak bonding interactions and possible migratory behavior of atoms. [35][36][37] Comparatively, the intercalation-type electrode materials with strong metal-anion bonding undergo a bonding strength decrease rather than bond breakage during ion insertion, [6,38] which resists deformation under stress and maintains a stable framework when incorporated with active components. [39][40][41] Moreover, 2D intercalation host frameworks with high electrical conductivity have been proven to not only buffer volume expansion of alloying metal but also greatly improve rate performance.…”
Section: Introductionmentioning
confidence: 99%
“…[36] Comparatively, the intercalative framework with relatively strong bond interactions can resist deformation under stress. [37,38] Rational integration of intercalative framework with alloying units has been demonstrated to not only promote diffusion kinetics and charge transfer but also provide improved intercalative redox pseudocapacitance. [39][40][41][42] Therefore, an ideal strategy to inhibit the aggregation of Bi is chemically confining Bi atoms into robust intercalative motifs through reversible metal-anion covalent bonding.…”
Section: Introductionmentioning
confidence: 99%