Cover Image

Vacancy-concentration-dependent thermal stability of fcc-(Ti,Al)Nx predicted via chemical-environment-sensitive diffusion activation energies

Fuente: arXiv

Saved in:

Bibliographic Details
Main Authors:	Nayak, Ganesh Kumar, Holec, David, Schneider, Jochen M.
Format:	Preprint
Published:	2025
Subjects:	Materials Science
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

Impact of O concentration on the thermal stability and decomposition mechanism of (Cr,Al)N compared to (Ti,Al)N thin films
by: Kümmerl, Pauline, et al.
Published: (2026)

Accurate prediction of structural and mechanical properties on amorphous materials enabled through machine-learning potentials: a case study of silicon nitride
by: Nayak, Ganesh Kumar, et al.
Published: (2024)

Revealing trends in catalytic activity of adatoms for hydrogen adsorption on carbon: a case study of graphene and carbon nanotube
by: Leiner, Thomas, et al.
Published: (2024)

Prediction and identification of point defect fingerprints in X-ray photoelectron spectra of TiN$_x$ with 1.18 $\le x \le$ 1.37
by: Ondračka, Pavel, et al.
Published: (2024)

Higher order magnetoelasticity energy corrections in bcc and fcc systems
by: Šebesta, Jakub, et al.
Published: (2026)

Connecting strain rate dependence of fcc metals to dislocation avalanche signatures
by: Aissaoui, M., et al.
Published: (2025)

Ab initio modeling of TWIP and TRIP effects in $β$-Ti alloys
by: Holec, David, et al.
Published: (2025)

Effects of alloying elements on carbon diffusion in the austenite (f.c.c.) and ferrite (b.c.c.) phases
by: Mao, Zugang, et al.
Published: (2024)

Morphology dependent decomposition and pore evolution during oxidation of Cr$_2$AlC coatings revealed by correlative tomography
by: Ramesh, Devi Janani, et al.
Published: (2026)

Interplay between alloying and tramp element effects on temper embrittlement in bcc iron: DFT and thermodynamic insights
by: Sakic, Amin, et al.
Published: (2024)

Heterophase fcc‐hcp‐fcc High‐Entropy Alloy Nanomaterials with Tailored Electron Divergence for Selective Ammonia Electrosynthesis
by: Xiang Meng, et al.
Published: (2026)

Bain distortion of noble metal thin films that exhibit fcc, bct, and reoriented fcc structures
by: Ono, Shota, et al.
Published: (2024)

Synthesis and study of fcc-Co derived from isostructural Co4N
by: Seema, et al.
Published: (2021)

Bond Formation at Polycarbonate | X Interfaces (X = Al2O3, TiO2, TiAlO2) Studied by Theory and Experiments
by: Lena Patterer, et al.
Published: (2024)

Modeling Kinetic Effects of Charged Vacancies on Electromechanical Responses of Ferroelectrics: Rayleighian Approach
by: Kumar, Rajeev, et al.
Published: (2024)

DFT and MLIP study of solute segregation to coherent and semi-coherent α-Fe/Fe$_3$C interfaces
by: Reiners-Sakic, Amin, et al.
Published: (2026)

Segregation to grain boundaries in disordered systems: an application to a Ni-based multi-component alloy
by: Gehringer, Dominik, et al.
Published: (2024)

SiNx RRAMs performance with different stoichiometries
by: Mavropoulis, A. E., et al.
Published: (2025)

Site‐Selective Growth of fcc‐2H‐fcc Copper on Unconventional Phase Metal Nanomaterials for Highly Efficient Tandem CO2 Electroreduction
by: Yangbo Ma, et al.
Published: (2024)

Spin order dependent skyrmion stabilization in MnFeCoGe hexagonal magnets
by: Chakrabartty, Dola, et al.
Published: (2023)

The interplay of local electron correlations and ultrafast spin dynamics in fcc Ni
by: Lojewski, Tobias, et al.
Published: (2022)

Band alignment of grafted diamond/GaN p-n heterojunctions interfaced with ALD Al2O3 and SiNx/Al2O3
by: Tsai, Tsung-Han, et al.
Published: (2026)

Emergent B2 chemical orderings in the AlTiVNb and AlTiCrMo refractory high-entropy superalloys studied via first-principles theory and atomistic modelling
by: Woodgate, Christopher D., et al.
Published: (2025)

Accounting for the length-scale dependence of thermal diffusivity in 3C-SiC measured with transient thermal gratings
by: Vasudeva, Keshav, et al.
Published: (2026)

Tribological Behavior of (CrAlVTiNbMo)Nx High‐Entropy Nitride Coatings Over a Wide Temperature Range
by: Xiaolong Lu, et al.
Published: (2025)

Multilayer Coatings of TiN/AlTiN: Experimental Characterization and FE Simulations
by: Lalit Kumar Sharma, et al.
Published: (2025)

Breakdown characteristics of SiNx with different stoichiometries for resistive memories
by: Mavropoulis, A. E., et al.
Published: (2025)

High-temperature stability of ambient-cured one-part alkali-activated materials incorporating graphene for thermal energy storage
by: Tran, Nghia, et al.
Published: (2024)

On energetics of allotrope transformations in transition-metal diborides via plane-by-plane shearing
by: Leiner, Thomas, et al.
Published: (2023)

Utilizing (Al, Ga)2O3/Ga2O3 superlattices to measure cation vacancy diffusion and vacancy-concentration-dependent diffusion of Al, Sn, and Fe in \b{eta} -Ga2O3
by: Rock, Nathan D., et al.
Published: (2024)

The use of the correlated Debye model for EXAFS-based thermometry in bcc and fcc metals
by: Kuzmin, Alexei, et al.
Published: (2024)

Effect of Silicon Atom Doping in SiNx Resistive Switching Films
by: Mavropoulis, A, et al.
Published: (2025)

Effect of size dependent strain at various coverage on island formation: Kinetic Monte Carlo study
by: Aryal, Ganesh
Published: (2024)

Stranski-Krastanov Growth of Disordered ScNx Thin Films on MgO(100): Influence of Defect Densities on Electronic Structure and Transport Properties
by: Chowdhury, Susmita, et al.
Published: (2025)

Single‐Source Precursor Synthesis of a Compositionally Complex Early Transitional Metal Carbonitride (Ti,Zr,Hf,Nb,Ta)NxC1−x
by: Dharma Teja Teppala, et al.
Published: (2024)

Beyond structural stabilization of highly-textured AlN thin film: the role of chemical effects
by: Pshyk, O. V., et al.
Published: (2024)

The effect of elastic-plastic mismatch and interface proximity on the fracture toughness of Ti-TiN thin films
by: Mathews, Nidhin George, et al.
Published: (2025)

Thermodynamic properties of fcc lead: A scalar and fully relativistic first principle study
by: Thakur, Balaram, et al.
Published: (2025)

Magnetic diffuse scattering of the $S$ = 5/2 fcc antiferromagnets Ba$_2$MnTeO$_6$ and Ba$_2$MnWO$_6$
by: Mustonen, Otto H. J., et al.
Published: (2024)

Stability and elasticity of metastable solid solutions and superlattices in the MoN-TaN system: a first-principles study
by: Koutná, Nikola, et al.
Published: (2017)