Search Results - "Yan, Hejin"
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Unlocking surface octahedral tilt in two-dimensional Ruddlesden-Popper perovskites
Published in Nature communications (10-01-2022)“…Molecularly soft organic-inorganic hybrid perovskites are susceptible to dynamic instabilities of the lattice called octahedral tilt, which directly impacts…”
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Pressure driven rotational isomerism in 2D hybrid perovskites
Published in Nature communications (25-01-2023)“…Multilayers consisting of alternating soft and hard layers offer enhanced toughness compared to all-hard structures. However, shear instability usually exists…”
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3
Surface asymmetry induced turn-overed lifetime of acoustic phonons in monolayer MoSSe
Published in iScience (19-05-2023)“…Recent successful growth of asymmetric transition metal dichalcogenides via accurate manipulation of different chalcogen atoms in top and bottom surfaces…”
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4
Excellent Infrared Nonlinear Optical Crystals BaMO(IO₃)₅ (M = V, Ta) Predicted by First Principle Calculations
Published in Materials (24-09-2018)“…Two nonlinear optical crystals, BaVO(IO₃)₅ and BaTaO(IO₃)₅, are designed by substituting Nb with V and Ta, respectively, in BaNbO(IO₃)₅, which is itself a…”
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Effects of Defect on Work Function and Energy Alignment of PbI2: Implications for Solar Cell Applications
Published in Chemistry of materials (08-02-2022)“…Two-dimensional (2D) layered lead iodide (PbI2) is an important precursor and common residual species during the synthesis of lead–halide perovskites. There…”
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Single Atomic Catalyst of Hydrogen Evolution Supported by Semimetallic γ‑GeSe
Published in Journal of physical chemistry. C (25-07-2024)“…Motivated by the recent synthesis of a new polymorph of germanium selenide (γ-GeSe) with a honeycomb lattice and an astonishingly high conductivity (even…”
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High‐Throughput Screening of Heterogeneous Transition Metal Dual‐Atom Catalysts by Synergistic Effect for Nitrate Reduction to Ammonia
Published in Advanced functional materials (01-08-2023)“…Nitrate reduction to ammonia has attracted much attention for nitrate (NO3‐) removal and ammonia (NH3) production. Identifying promising catalyst for active…”
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Strongly Modulated Exfoliation and Functionalization of MXenes with Rationally Designed Groups in Polymer: A Theoretical Study
Published in Chemistry of materials (08-11-2022)“…As emerging atomically ultrathin metal compounds, MXenes show great promise for catalytic and nanoelectronic applications due to their abundant surface…”
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Effects of Defect on Work Function and Energy Alignment of PbI 2 : Implications for Solar Cell Applications
Published in Chemistry of materials (08-02-2022)Get full text
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10
High-performance thermoelectric monolayer γ-GeSe and its group-IV monochalcogenide isostructural family
Published in Chemical engineering journal (Lausanne, Switzerland : 1996) (15-02-2023)Get full text
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Promoted Electronic Coupling of Acoustic Phonon Modes in Doped Semimetallic MoTe2
Published in ACS nano (12-09-2023)“…As a prototype of the Weyl superconductor, layered molybdenum ditelluride (MoTe2) encompasses two semimetallic phases (1T′ and Td) which differentiate from…”
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Promoted Electronic Coupling of Acoustic Phonon Modes in Doped Semimetallic MoTe 2
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13
Comprehensively-upgraded polymer electrolytes by multifunctional aramid nanofibers for stable all-solid-state Li-ion batteries
Published in Nano energy (01-03-2020)“…Satisfactory ionic conductivity and mechanical stability are the prerequisites for the applications of solid polymer electrolytes in Li-ion batteries. Herein,…”
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14
Mechanism of Interaction of Water above the Methylammonium Lead Iodide Perovskite Nanocluster: Size Effect and Water-Induced Defective States
Published in The journal of physical chemistry letters (18-01-2024)“…Water is often viewed as detrimental to organic halide perovskite stability. However, evidence highlights its efficacy as a solvent during organic perovskite…”
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15
Hierarchical nanosheets constructed by integration of bimetallic sulfides into N-Doped carbon: Enhanced diffusion kinetics and cycling stability for sodium storage
Published in Nano energy (01-08-2019)“…Transition metal sulfides (TMS) are considered as anode candidates for sodium-ion batteries (SIBs) due to the high theoretical specific capacity and natural…”
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Ferroelasticity in Two-Dimensional Hybrid Ruddlesden–Popper Perovskites Mediated by Cross-Plane Intermolecular Coupling and Metastable Funnel-like Phases
Published in ACS nano (04-06-2024)“…Ferroelasticity is a phenomenon in which a material exhibits two or more equally stable orientation variants and can be switched from one form to another under…”
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Additive Molecules Adsorbed on Monolayer PbI2: Atomic Mechanism of Solvent Engineering for Perovskite Solar Cells
Published in ACS applied materials & interfaces (12-07-2023)“…Solvent engineering is highly essential for the upscaling synthesis of high-quality metal halide perovskite materials for solar cells. The complexity in the…”
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Flatten the Li‐ion Activation in Perfectly Lattice‐Matched MXene and 1T‐MoS2 Heterostructures via Chemical Functionalization
Published in Advanced materials interfaces (01-03-2022)“…The complexity of the ionic and electronic dynamics in MXene based hybrids, which are normally involved for device integration, triggers both challenges and…”
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Size and stoichiometric dependence of thermal conductivities of InxGa1-xN: A molecular dynamics study
Published in Computational materials science (01-05-2022)“…The thermal conductivities κ of wurtzite InxGa1-xN are investigated using equilibrium molecular dynamics (MD) method. The κ of InxGa1-xN rapidly declines from…”
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Fast Intercalation of Lithium in Semi‐Metallic γ‐GeSe Nanosheet: A New Group‐IV Monochalcogenide for Lithium‐Ion Battery Application
Published in ChemSusChem (05-08-2022)“…Existence of van der Waals gaps renders two‐dimensional (2D) materials ideal passages of lithium for being used as anode materials. However, the requirement of…”
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