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Dynamical matrices, Born effective charges, dielectric permittivity tensors, and interatomic force constants from density-functional perturbation theory
W‐Alloying Induced Long‐Period Stacking Ordering in Easily Delaminated (V, W) 4/3 Zr 2/3 AlC i ‐MAX and Excellent Antitumor Performance of (V, W) 1.33 C i ‐MXene Derivatives
The Role of Cation Vacancies in Electrode Materials for Enhanced Electrochemical Energy Storage: Synthesis, Advanced Characterization, and Fundamentals
Harnessing the Potential of MXenes for Electrochemical Nitrogen and Carbon Dioxide Reduction Reactions: Recent Advances Based on First-Principles Simulations
Synthesis of Two-Dimensional Nb1.33C (MXene) with Randomly Distributed Vacancies by Etching of the Quaternary Solid Solution (Nb2/3Sc1/3)2AlC MAX Phase
First-principles study of the structural, electronic, elastic, and high-pressure properties of the (V 2/3 Zr 1/3 ) 2 AlC i-MAX phase and M 2 AlC (M = V, Zr) MAX phases
Electronic structure, bonding characteristics, and mechanical properties in (W 2/3 Sc 1/3 ) 2 AlC and (W 2/3 Y 1/3 ) 2 AlC i -MAX phases from first-principles calculations
Materials synthesis, neutron powder diffraction, and first-principles calculations of (MoxSc1−x)2AlC i−MAX phase used as parent material for MXene derivation
Templated syntheses towards new boron-based nanomaterials
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