Fluorine-mediated selective etching of Ti-based MAX phases: A DFT study on electronic structure, vacancy dynamics, and MXene synthesis
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OpenAlex topics: MXene and MAX Phase Materials · Graphene research and applications · Energetic Materials and Combustion
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References (46)
Show source-provided references
1. Recent advances in the carrier mobility of two-dimensional materials: a theoretical perspective10.1021/acsomega.0c01676 ↗
2. Chemical sensing with 2D materials10.1039/C8CS00417J ↗
3. Biofunctionalization of graphene and its two-dimensional analogues and synthesis of biomimetic materials: a review10.1007/s10853-021-06787-0 ↗
4. Chemical vapor deposition growth and applications of two-dimensional materials and their heterostructures10.1021/acs.chemrev.7b00536 ↗
5. Metrology for 2D materials: a perspective review from the international roadmap for devices and systems10.1039/D3NA01148H ↗
6. Janus two-dimensional transition metal dichalcogenides10.1063/5.0095203 ↗
7. 2D Re-based transition metal chalcogenides: progress, challenges, and opportunities10.1002/advs.202002320 ↗
8. Hexagonal boron nitride on III-V compounds: a review of the synthesis and applications10.3390/ma15134396 ↗
9. Piezoelectricity in monolayer hexagonal boron nitride
10. 2D MXenes: tunable mechanical and tribological properties10.1002/adma.202007973 ↗
11. Element replacement approach by reaction with Lewis acidic molten salts to synthesize nanolaminated MAX phases and MXenes10.1021/jacs.9b00574 ↗
12. Enabling the transition to ductile MAX phases and the exfoliation to MXenes via tuning the A element10.1111/jace.19026 ↗
13. A general Lewis acidic etching route for preparing MXenes with enhanced electrochemical performance in non-aqueous electrolyte10.1038/s41563-020-0657-0 ↗
14. Perspectives on preparation of two-dimensional MXenes10.1080/14686996.2021.1972755 ↗
15. MXene-based materials for electrochemical sodium-ion storage10.1002/advs.202003185 ↗
16. Atomic scale design of MXenes and their parent materials-from theoretical and experimental perspectives10.1021/acs.chemrev.3c00241 ↗
17. Insights into exfoliation possibility of MAX phases to MXenes10.1039/C7CP08645H ↗
18. First-principles study of vacancies in Ti3SiC2 and Ti3AlC210.3390/ma10020103 ↗
19. First-principles investigation of the vacancy effect on the electronic properties in M2AlC (M = V and Nb)
20. Nanomechanical properties of Ti3C2 mxene10.1021/acs.langmuir.9b02619 ↗
21. MXene materials for designing advanced separation membranes10.1002/adma.201906697 ↗
22. Ultralight Ti3C2Tx MXene foam with superior microwave absorption performance10.1016/j.cej.2020.127283 ↗
23. Roadmap on two-dimensional materials for energy storage and conversion
24. Electromagnetic interference shielding with 2D transition metal carbides (MXenes)10.1126/science.aag2421 ↗
25. Structural design and preparation of Ti3C2Tx MXene/polymer composites for absorption-dominated electromagnetic interference shielding10.1039/D3NA00130J ↗
26. Flexible and conductive MXene films and nanocomposites with high capacitance10.1073/pnas.1414215111 ↗
27. High-thermal-stability and high-thermal-conductivity Ti3C2TxMXene/Poly (vinyl alcohol) (PVA) composites10.1021/acsomega.7b02001 ↗
28. Universal strategy for HF-free facile and rapid synthesis of two-dimensional MXenes as multifunctional energy materials10.1021/jacs.9b02578 ↗
29. MXenes and MXene-based materials for tissue engineering and regenerative medicine: recent advances10.1039/D1MA00189B ↗
30. First-principles study of ceramic material (Ti1-xNbx)2AlC compounds and its compressive behavior under pressure up to 55 GPa10.1016/j.jallcom.2014.05.142 ↗
31. Delineation of the reaction mechanism of Ti2AlC MAX-phase formation during spark plasma sintering synthesis10.1111/jace.70130 ↗
32. Phonon and electronic properties of Ti2SiC from first-principles calculations10.1016/j.ssc.2014.12.010 ↗
33. Electronic structures of and composition gaps among the ternary carbides Ti2MC10.1103/PhysRevB.74.184113 ↗
34. The structure, elastic and thermodynamic properties of Ti2GaC from first-principles calculation10.1142/S0217979219500309 ↗
35. Native point defects in Ti3GeC2 and Ti2GeC10.1016/j.commatsci.2016.11.023 ↗
36. Theoretical study of mechanical, electronic, chemical bonding and optical properties of Ti2SnC, Zr2SnC, Hf2SnC and Nb2SnC10.1016/j.commatsci.2009.09.015 ↗
37. Fabrication and electrical and thermal properties of Ti2InC, Hf2InC and (Ti,Hf)2InC10.1016/S0925-8388(02)00107-X ↗
38. Stability, mechanical, and thermodynamic behaviors of (TiZrHfTaM)C (M = Nb, Mo, W, V, Cr) high-entropy carbide ceramics10.1016/j.jallcom.2022.163868 ↗
39. Vacancy formation energies and migration barriers in multi-principal element alloys10.1016/j.actamat.2021.117611 ↗
40. Anomalously low vacancy formation energies and migration barriers at Cu/AlN interfaces from ab initio calculations10.1016/j.scriptamat.2024.116126 ↗
41. Study on the densification of osmium by experiment and first principle calculations10.3390/ma15228011 ↗
42. From two-, one-, to zero-dimensional vacancies: a densification pattern for a typcial transition-metal dichalcogenide of TiSe210.1021/acs.jpclett.1c02308 ↗
43. Strain dependence of energetics and kinetics of vacancy in tungsten10.3390/ma13153375 ↗
44. Recent advances in MXene-based composites for piezoelectric sensors10.1039/D4NR03233K ↗
45. Fundamentals of MXene synthesis10.1038/s44160-022-00104-6 ↗
46. Advances in mixed tin-lead narrow-bandgap perovskites for single-junction and all-perovskite tandem solar cells