IU Indianapolis ScholarWorks :: Browsing by Subject "2D materials"

Browsing by Subject "2D materials"

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2D MXenes: Tunable Mechanical and Tribological Properties
(Wiley, 2021-04-28) Wyatt, Brian C.; Rosenkranz, Andreas; Anasori, Babak; Mechanical and Energy Engineering, School of Engineering and Technology
2D transition metal carbides, nitrides, and carbonitrides, known as MXenes, were discovered in 2011 and have grown to prominence in energy storage, catalysis, electromagnetic interference shielding, wireless communications, electronic, sensors, and environmental and biomedical applications. In addition to their high electrical conductivity and electrochemically active behavior, MXenes' mechanical properties, flexibility, and strong adhesion properties play crucial roles in almost all of these growing applications. Although these properties prove to be critical in MXenes' impressive performance, the mechanical and tribological understanding of MXenes, as well as their relation to the synthesis process, is yet to be fully explored. Here, a fundamental overview of MXenes' mechanical and tribological properties is provided and the effects of MXenes' compositions, synthesis, and processing steps on these properties are discussed. Additionally, a critical perspective of the compositional control of MXenes for innovative structural, low-friction, and low-wear performance in current and upcoming applications of MXenes is provided. It is established here that the fundamental understanding of MXenes' mechanical and tribological behavior is essential for their quickly growing applications.
Covalent Surface Modification of Ti3C2Tx MXene with Chemically Active Polymeric Ligands Producing Highly Conductive and Ordered Microstructure Films
(American Chemical Society (ACS), 2021-11-17) Lee, Jacob T.; Wyatt, Brian C.; Davis, Gregory A., Jr.; Masterson, Adrianna N.; Pagan, Amber L.; Shah, Archit; Anasori, Babak; Sardar, Rajesh; Chemistry, School of Science
As interest continues to grow in Ti3C2Tx and other related MXenes, advancement in methods of manipulation of their surface functional groups beyond synthesis-based surface terminations (Tx: −F, −OH, and ═O) can provide mechanisms to enhance solution processability as well as produce improved solid-state device architectures and coatings. Here, we report a chemically important surface modification approach in which “solvent-like” polymers, polyethylene glycol carboxylic acid (PEG6-COOH), are covalently attached onto MXenes via esterification chemistry. Surface modification of Ti3C2Tx with PEG6-COOH with large ligand loading (up to 14% by mass) greatly enhances dispersibility in a wide range of nonpolar organic solvents (e.g., 2.88 mg/mL in chloroform) without oxidation of Ti3C2Tx two-dimensional flakes or changes in the structure ordering. Furthermore, cooperative interactions between polymer chains improve the nanoscale assembly of uniform microstructures of stacked MXene-PEG6 flakes into ordered thin films with excellent electrical conductivity (∼16,200 S·cm–1). Most importantly, our covalent surface modification approach with ω-functionalized PEG6 ligands (ω-PEG6-COOH, where ω: −NH2, −N3, −CH═CH2) allows for control over the degree of functionalization (incorporation of valency) of MXene. We believe that installing valency onto MXenes through short, ion conducting PEG ligands without compromising MXenes’ features such as solution processability, structural stability, and electrical conductivity further enhance MXenes surface chemistry tunability and performance and widens their applications.
High temperature phase behavior of 2D transition metal carbides
(2024-08) Wyatt, Brian C.; Anasori, Babak; Trice, Rodney; Zhang, Jing; Hood, Zachary
The technological drive of humanity to explore the cosmos, travel at hypersonic speeds, and pursue clean energy solutions requires ceramic scientists and engineers to constantly push materials to their functional, behavioral, and chemical extremes. Ultra-high temperature ceramics, and particularly transition metal carbides, are promising materials to meet the demands of extreme environment materials with their >4000 °C melting temperature and impressive thermomechanical behaviors in extreme conditions. The advent of the 2D version of these transition metal carbides, known as MXenes, added a new direction to design transition metal carbides for energy, catalysis, flexible electronics, and other applications. Toward extreme conditions, although MXenes remain yet unexplored, we believe that the ~1 nm flakes of MXenes gives ceramics scientists and engineers the ability to truly engineer transition metal carbides layer-by-layer at the nanoscale to endure the extreme conditions required by future harsh environment technology. Although MXenes have this inherent promise, fundamental study of their behavior in high-temperature environments is necessary to understand how their chemistry and 2D nature affects the high- temperature stability and phase behavior of MXenes toward application in extreme environments. In this dissertation, we investigate the high-temperature phase behavior of 2D MXenes in high temperature inert environments to understand the stability and phase transition behavior of MXenes. In this work, we demonstrate that 1) MXenes’ transition at high-temperatures is to highly textured transition metal carbides is due to the homoepitaxial growth of these phases onto ~1-nm- thick MXenes’ highly exposed basal plane, 2) the MXene to MXene interface plays a major role in the phase behavior of MXenes, particularly toward building layered transition metal carbides using MXenes as ~1-nm-thick building blocks, and 3) Defects are the primary site at which atomic migration begins during phase transition of MXenes into these highly textured transition metal carbides, and these defects can be engineered for different phase stability of MXenes. To do so, we investigate the phase behavior of Ti3C2Tx, Ta4C3Tx, Mo2TiC2Tx, and other MXenes using a combination of in situ x-ray diffraction and scanning transmission electron microscopy and other ex situ methods, such as secondary ion mass spectrometry and x-ray photoelectron spectroscopy, with other methods. By investigating the fundamentals of the high-temperature phase behavior of MXenes, we hope to establish the basic principles behind use of MXenes as the ideal material for application in future extreme environments.
High-Entropy 2D Carbide MXenes: TiVNbMoC3 and TiVCrMoC3
(ACS, 2021-06) Nemani, Srinivasa Kartik; Zhang, Bowen; Wyatt, Brian C.; Hood, Zachary D.; Manna, Sukrita; Khaledialidusti, Rasoul; Hong, Weichen; Sternberg, Michael G.; Sankaranarayanan, Subramanian K. R. S.; Anasori, Babak; Mechanical and Energy Engineering, School of Engineering and Technology
Two-dimensional (2D) transition metal carbides and nitrides, known as MXenes, are a fast-growing family of 2D materials. MXenes 2D flakes have n + 1 (n = 1–4) atomic layers of transition metals interleaved by carbon/nitrogen layers, but to-date remain limited in composition to one or two transition metals. In this study, by implementing four transition metals, we report the synthesis of multi-principal-element high-entropy M4C3Tx MXenes. Specifically, we introduce two high-entropy MXenes, TiVNbMoC3Tx and TiVCrMoC3Tx, as well as their precursor TiVNbMoAlC3 and TiVCrMoAlC3 high-entropy MAX phases. We used a combination of real and reciprocal space characterization (X-ray diffraction, X-ray photoelectron spectroscopy, energy dispersive X-ray spectroscopy, and scanning transmission electron microscopy) to establish the structure, phase purity, and equimolar distribution of the four transition metals in high-entropy MAX and MXene phases. We use first-principles calculations to compute the formation energies and explore synthesizability of these high-entropy MAX phases. We also show that when three transition metals are used instead of four, under similar synthesis conditions to those of the four-transition-metal MAX phase, two different MAX phases can be formed (i.e., no pure single-phase forms). This finding indicates the importance of configurational entropy in stabilizing the desired single-phase high-entropy MAX over multiphases of MAX, which is essential for the synthesis of phase-pure high-entropy MXenes. The synthesis of high-entropy MXenes significantly expands the compositional variety of the MXene family to further tune their properties, including electronic, magnetic, electrochemical, catalytic, high temperature stability, and mechanical behavior.
High-temperature stability and phase transformations of titanium carbide (Ti3C2Tx) MXene
(IOP, 2021-06) Wyatt, Brian C.; Nemani, Srinivasa Kartik; Desai, Krishay; Kaur, Harpreet; Zhang, Bowen; Anasori, Babak; Mechanical and Energy Engineering, School of Engineering and Technology
Two-dimensional (2D) transition metal carbides, nitrides, and carbonitrides, known as MXenes, are under increasing pressure to meet technological demands in high-temperature applications, as MXenes can be considered to be one of the few ultra-high temperature 2D materials. Although there are studies on the stability of their surface functionalities, there is currently a gap in the fundamental understanding of their phase stability and transformation of MXenes' metal carbide core at high temperatures (>700 °C) in an inert environment. In this study, we conduct systematic annealing of Ti3C2TxMXene films in which we present the 2D MXene flake phase transformation to ordered vacancy superstructure of a bulk three-dimensional (3D) Ti2C and TiCycrystals at 700 °C ⩽T⩽ 1000 °C with subsequent transformation to disordered carbon vacancy cubic TiCyat higher temperatures (T> 1000 °C). We annealed Ti3C2TxMXene films made from the delaminated MXene single-flakes as well as the multi-layer MXene clay in a controlled environment through the use ofin situhot stage x-ray diffraction (XRD) paired with a 2D detector (XRD2) up to 1000 °C andex situannealing in a tube furnace and spark plasma sintering up to 1500 °C. Our XRD2analysis paired with cross-sectional scanning electron microscope imaging indicated the resulting nano-sized lamellar and micron-sized cubic grain morphology of the 3D crystals depend on the starting Ti3C2Txform. While annealing the multi-layer clay Ti3C2TxMXene creates TiCygrains with cubic and irregular morphology, the grains of 3D Ti2C and TiCyformed by annealing Ti3C2TxMXene single-flake films keep MXenes' lamellar morphology. The ultrathin lamellar nature of the 3D grains formed at temperatures >1000 °C can pave way for applications of MXenes as a stable carbide material 2D additive for high-temperature applications.
Laser Shock Tuning Dynamic Interlayer Coupling in Graphene–Boron Nitride Moiré Superlattices
(ACS, 2019) Kumar, Prashant; Liu, Jing; Motlag, Maithilee; Tong, Lei; Hu, Yaowu; Huang, Xinyu; Bandopadhyay, Arkamita; Pati, Swapan K.; Ye, Lei; Irudayaraj, Joseph; Cheng, Gary J.; Physics, School of Science
In the emergence of graphene and many two-dimensional (2D) materials, the most exciting applications come from stacking them into 3D devices, promising many excellent possibilities for neoteric electronics and optoelectronics. Layers of semiconductors, insulators, and conductors can be stacked to form van der Waals heterostructures, after the weak bonds formed between the layers. However, the interlayer coupling in these heterostructures is usually hard to modulate, resulting in difficulty to realize their emerging optical or electronic properties. Especially, the relationship between interlayer distance and interlayer coupling remains to be investigated, due to the lack of effective technology. In this work, we have used laser shocking to controllably tune the interlayer distance between graphene (Gr) and boron nitride (BN) in the Gr/BN/Gr heterostructures and the strains in the 2D heterolayers, providing a simple and effective way to modify their optic and electronic properties. After lase shocking, the reduction of interlayer distance is calculated by molecular dynamics (MD) simulation. Some atoms in Gr or BN are out-of-plane as well. In Raman measurements, the G peak in the heterostructure shows a red-shifted trend after laser shocking, indicating the strong phonon coupling in the interlayer. Moreover, the larger transparency after laser shocking also verifies the stronger photon coupling in the heterostructure. To investigate the effects of the interlayer coupling of heterostructure on its out-of-plane electronic behavior, we have investigated the electronic tunneling behavior. The heterostructure after laser shock reveals a lager tunneling current and lower tunneling threshold, proving an unexpected better electrical property. From DFT calculations, laser shocking can modulate the band gap structure of graphene in Gr/BN/Gr heterostructures; therefore, the heterostructures can be implemented as a unique photonic platform to modulate the emission characters of the anchored CdSe/ZnS core–shell quantum dots. Remarkably, the effective laser shocking method is also applicable to various otherwise noninteracting 2D materials, resulting in many new phenomena, which will lead science and technology to unexplored territories.
MXenes: The two-dimensional influencers
(Elsevier, 2022) Firouzjaei, Mostafa Dadashi; Karimiziarani, Mohammadsepehr; Moradkhani, Hamid; Elliott, Mark; Anasori, Babak; Mechanical and Energy Engineering, Purdue School of Engineering and Technology
MXenes have significantly impacted materials science and nanotechnology since their discovery in 2011. Theoretical calculations have predicted more than 100 possible compositions of MXenes and lab-scale fabrication of more than 40 MXene structures has been reported to date. The unique characteristics of MXenes have made them an ideal fit for a wide variety of applications, including energy storage, environmental, electronics, communications, gas and liquid separations and adsorption, biomedical, and optoelectronics. MXene attracted many researchers, and as a result, publication trends on MXene have grown exponentially in recent years. By 2021, MXenes have already shown promise in several research areas, including energy storage devices, electromagnetic interference shielding, nanocomposites, and hybrid materials. In parallel, new applications are emerging where MXenes outperform other nanomaterials, such as in tribology. MXene compositions are also being expanded rapidly. Here, we briefly overview the history, properties, trends, and application of MXenes to better understand their potentials and familiarize new audiences with this 2D material family.
Perspectives of 2D MXene Tribology
(Wiley, 2023) Rosenkranz, Andreas; Righi, Maria Clelia; Sumant, Anirudha V.; Anasori, Babak; Mochalin, Vadym N.; Mechanical and Energy Engineering, Purdue School of Engineering and Technology
The large and rapidly growing family of two-dimensional early transition metal carbides, nitrides, and carbonitrides (MXenes) raises significant interest in the materials science and chemistry of materials communities. Discovered a little more than a decade ago, MXenes have already demonstrated outstanding potential in various applications ranging from energy storage to biology and medicine. The past two years have witnessed increased experimental and theoretical efforts toward studying MXenes’ mechanical and tribological properties when used as lubricant additives, reinforcement phases in composites, or solid lubricant coatings. Although research on the understanding of the friction and wear performance of MXenes under dry and lubricated conditions is still in its early stages, it has experienced rapid growth due to the excellent mechanical properties and chemical reactivities offered by MXenes that make them adaptable to being combined with other materials, thus boosting their tribological performance. In this perspective, we summarize the most promising results in the area of MXene tribology, outline future important problems to be pursued further, and provide methodological recommendations that we believe could be useful for experts, as well as newcomers to MXenes research, in particular, to the emerging area of MXene tribology.
Sculpting Liquids with Two-Dimensional Materials: The Assembly of Ti3C2Tx MXene Sheets at Liquid–Liquid Interfaces
(ACS, 2019-10) Cain, Jeffrey D.; Azizi, Amin; Maleski, Kathleen; Anasori, Babak; Glazer, Emily C.; Kim, Paul Y.; Gogotski, Yury; Helms, Brett A.; Russell, Thomas P.; Zettl, Alex; Mechanical Engineering and Energy, School of Engineering and Technology
The self-assembly of nanoscale materials at the liquid–liquid interface allows for fabrication of three-dimensionally structured liquids with nearly arbitrary geometries and tailored electronic, optical, and magnetic properties. Two-dimensional (2D) materials are highly anisotropic, with thicknesses on the order of a nanometer and lateral dimensions upward of hundreds of nanometers to micrometers. Controlling the assembly of these materials has direct implications for their properties and performance. We here describe the interfacial assembly and jamming of Ti3C2Tx MXene nanosheets at the oil–water interface. Planar, as well as complex, programmed three-dimensional all-liquid objects are realized. Our approach presents potential for the creation of all-liquid 3D-printed devices for possible applications in all-liquid electrochemical and energy storage devices and electrically active, all-liquid fluidics that exploits the versatile structure, functionality, and reconfigurability of liquids.
Ti3C2Tx MXene Polymer Composites for Anticorrosion: An Overview and Perspective
(American Chemical Society, 2022) Amin, Ihsan; van den Brekel, Hidde; Nemani, Kartik; Batyrev, Erdni; de Vooys, Arnoud; van der Weijde, Hans; Anasori, Babak; Shiju, N. Raveendran; Mechanical and Energy Engineering, School of Engineering and Technology
As the most studied two-dimensional (2D) material from the MXene family, Ti3C2Tx has constantly gained interest from academia and industry. Ti3C2Tx MXene has the highest electrical conductivity (up to 24,000 S cm-1) and one of the highest stiffness values with a Young's modulus of ∼ 334 GPa among water-dispersible conductive 2D materials. The negative surface charge of MXene helps to disperse it well in aqueous and other polar solvents. This solubility across a wide range of solvents, excellent interface interaction, tunable surface functionality, and stability with other organic/polymeric materials combined with the layered structure of Ti3C2Tx MXene make it a promising material for anticorrosion coatings. While there are many reviews on Ti3C2Tx MXene polymer composites for catalysis, flexible electronics, and energy storage, to our knowledge, no review has been published yet on MXenes' anticorrosion applications. In this brief report, we summarize the current progress and the development of Ti3C2Tx polymer composites for anticorrosion. We also provide an outlook and discussion on possible ways to improve the exploitation of Ti3C2Tx polymer composites as anticorrosive materials. Finally, we provide a perspective beyond Ti3C2Tx MXene composition for the development of future anticorrosion coatings.

Browsing by Subject "2D materials"

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