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Short-range order and compositional phase stability in refractory high-entropy alloys via first-principles theory and atomistic modeling: NbMoTa, NbMoTaW, and VNbMoTaW

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Outgoing claims: the papers this work cites, builds on, or argues with.

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Nanostructured High‐Entropy Alloys with Multiple Principal Elements: Novel Alloy Design Concepts and Outcomes
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Magnetic and Electronic Properties of Complex Oxides from First‐Principles
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Hybrid Monte Carlo/Molecular Dynamics Simulation of a Refractory Metal High Entropy Alloy
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Short-Range Order in High Entropy Alloys: Theoretical Formulation and Application to Mo-Nb-Ta-V-W System
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Prediction of A2 to B2 Phase Transition in the High-Entropy Alloy Mo-Nb-Ta-W
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Monte carlo study of the phase diagrams of binary alloys with face centered cubic lattice structure
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Ordering in substitutional and interstitial solid solutions
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Size-dependent plasticity in an Nb25Mo25Ta25W25 refractory high-entropy alloy
inferredcites →https://doi.org/10.1016/j.actamat.2017.12.061openalex-snapshot
Phase stability and transformation in a light-weight high-entropy alloy
inferredcites →https://doi.org/10.1016/j.actamat.2019.01.023openalex-snapshot
Phase selection motifs in High Entropy Alloys revealed through combinatorial methods: Large atomic size difference favors BCC over FCC
inferredcites →https://doi.org/10.1016/j.actamat.2019.03.012openalex-snapshot
Machine-learning phase prediction of high-entropy alloys
inferredcites →https://doi.org/10.1016/j.actamat.2020.02.063openalex-snapshot
First-principles prediction of incipient order in arbitrary high-entropy alloys: exemplified in Ti0.25CrFeNiAl
inferredcites →https://doi.org/10.1016/j.commatsci.2020.110135openalex-snapshot
Monte Carlo simulation of order-disorder transition in refractory high entropy alloys: A data-driven approach
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Thermodynamics of concentrated solid solution alloys
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Refractory high-entropy alloys
inferredcites →https://doi.org/10.1016/j.intermet.2011.01.004openalex-snapshot
Mechanical properties of Nb25Mo25Ta25W25 and V20Nb20Mo20Ta20W20 refractory high entropy alloys
inferredcites →https://doi.org/10.1016/j.jallcom.2016.02.108openalex-snapshot
First principles exploration of near-equiatomic NiFeCrCo high entropy alloys
inferredcites →https://doi.org/10.1016/j.matchar.2018.06.019openalex-snapshot
Ab initio phase stabilities and mechanical properties of multicomponent alloys: A comprehensive review for high entropy alloys and compositionally complex alloys
inferredcites →https://doi.org/10.1016/j.matdes.2016.11.079openalex-snapshot
Alloying effect on the elastic properties of refractory high-entropy alloys
inferredcites →https://doi.org/10.1016/j.msea.2003.10.257openalex-snapshot
Microstructural development in equiatomic multicomponent alloys
inferredcites →https://doi.org/10.1016/j.scriptamat.2021.114450openalex-snapshot
Short-range order localizing diffusion in multi-principal element alloys
inferredcites →https://doi.org/10.1017/cbo9780511805769openalex-snapshot
Electronic Structure
inferredcites →https://doi.org/10.1017/cbo9780511813467openalex-snapshot
Principles of Condensed Matter Physics
inferredcites →https://doi.org/10.1017/cbo9781139696463openalex-snapshot
A Guide to Monte Carlo Simulations in Statistical Physics
inferredcites →https://doi.org/10.1038/ncomms8748openalex-snapshot
Ultrastrong ductile and stable high-entropy alloys at small scales
inferredcites →https://doi.org/10.1038/s41467-018-06757-2openalex-snapshot
Predictive multiphase evolution in Al-containing high-entropy alloys
inferredcites →https://doi.org/10.1038/s41467-020-16083-1openalex-snapshot
Yield strength and misfit volumes of NiCoCr and implications for short-range-order
inferredcites →https://doi.org/10.1038/s41524-017-0049-4openalex-snapshot
First-principles prediction of high-entropy-alloy stability
inferredcites →https://doi.org/10.1038/s41524-019-0195-yopenalex-snapshot
Impact of lattice relaxations on phase transitions in a high-entropy alloy studied by machine-learning potentials
inferredcites →https://doi.org/10.1038/s41524-020-0308-7openalex-snapshot
Machine-learning informed prediction of high-entropy solid solution formation: Beyond the Hume-Rothery rules
inferredcites →https://doi.org/10.1038/s41524-020-0339-0openalex-snapshot
Complex strengthening mechanisms in the NbMoTaW multi-principal element alloy
inferredcites →https://doi.org/10.1038/s41578-019-0121-4openalex-snapshot
High-entropy alloys
inferredcites →https://doi.org/10.1038/s41586-020-2275-zopenalex-snapshot
Short-range order and its impact on the CrCoNi medium-entropy alloy
inferredcites →https://doi.org/10.1038/s41586-021-03428-zopenalex-snapshot
Direct observation of chemical short-range order in a medium-entropy alloy
inferredcites →https://doi.org/10.1063/5.0025310openalex-snapshot
Frontiers in atomistic simulations of high entropy alloys
inferredcites →https://doi.org/10.1073/pnas.1808660115openalex-snapshot
Tunable stacking fault energies by tailoring local chemical order in CrCoNi medium-entropy alloys
inferredcites →https://doi.org/10.1080/21663831.2016.1198837openalex-snapshot
Long-ranged interactions in bcc NbMoTaW high-entropy alloys
inferredcites →https://doi.org/10.1088/0305-4608/6/11/005openalex-snapshot
Generalized perturbation theory in disordered transitional alloys: Applications to the calculation of ordering energies
inferredcites →https://doi.org/10.1088/0965-0393/18/1/015012openalex-snapshot
Visualization and analysis of atomistic simulation data with OVITO–the Open Visualization Tool
inferredcites →https://doi.org/10.1088/2053-2563/aae7d8openalex-snapshot
Multiple Scattering Theory
inferredcites →https://doi.org/10.1093/oso/9780198803195.001.0001openalex-snapshot
Computer Simulation of Liquids
inferredcites →https://doi.org/10.1098/rspa.1934.0132openalex-snapshot
The effect of thermal agitation on atomic arrangement in alloys
inferredcites →https://doi.org/10.1098/rspa.1935.0165openalex-snapshot
The effect of thermal agitaion on atomic arrangement in alloys—II
inferredcites →https://doi.org/10.1103/physrev.138.a1384openalex-snapshot
Short-Range Order and Long-Range Order Parameters
inferredcites →https://doi.org/10.1103/physrev.156.809openalex-snapshot
Coherent-Potential Model of Substitutional Disordered Alloys
inferredcites →https://doi.org/10.1103/physrev.77.669openalex-snapshot
An Approximate Theory of Order in Alloys
inferredcites →https://doi.org/10.1103/physrevb.102.174209openalex-snapshot
Generalized small set of ordered structures method for the solid-solution phase of high-entropy alloys
inferredcites →https://doi.org/10.1103/physrevb.103.104107openalex-snapshot
Chemical short-range ordering and its strengthening effect in refractory high-entropy alloys
inferredcites →https://doi.org/10.1103/physrevb.105.115124openalex-snapshot
Compositional phase stability in medium-entropy and high-entropy Cantor-Wu alloys from an ab initio all-electron Landau-type theory and atomistic modeling
inferredcites →https://doi.org/10.1103/physrevb.13.5188openalex-snapshot
Special points for Brillouin-zone integrations
inferredcites →https://doi.org/10.1103/physrevb.21.3222openalex-snapshot
Calculating properties with the coherent-potential approximation
inferredcites →https://doi.org/10.1103/physrevb.36.4630openalex-snapshot
Configurational energies and effective cluster interactions in substitutionally disordered binary alloys
inferredcites →https://doi.org/10.1103/physrevb.37.5982openalex-snapshot
First-principles study of ordering properties of substitutional alloys using the generalized perturbation method
inferredcites →https://doi.org/10.1103/physrevb.41.9701openalex-snapshot
Total-energy and pressure calculations for random substitutional alloys
inferredcites →https://doi.org/10.1103/physrevb.45.13244openalex-snapshot
Accurate and simple analytic representation of the electron-gas correlation energy
inferredcites →https://doi.org/10.1103/physrevb.50.1450openalex-snapshot
Compositional short-range ordering in metallic alloys: Band-filling, charge-transfer, and size effects from a first-principles all-electron Landau-type theory
inferredcites →https://doi.org/10.1103/physrevb.54.16470openalex-snapshot
Linear-response theory and lattice dynamics: A muffin-tin-orbital approach
inferredcites →https://doi.org/10.1103/physrevb.70.125115openalex-snapshot
Atomic and magnetic configurational energetics by the generalized perturbation method
inferredcites →https://doi.org/10.1103/physrevb.84.104115openalex-snapshot
Phase stability, point defects, and elastic properties of W-V and W-Ta alloys
inferredcites →https://doi.org/10.1103/physrevb.91.224204openalex-snapshot
Atomic short-range order and incipient long-range order in high-entropy alloys
inferredcites →https://doi.org/10.1103/physrevb.93.054206openalex-snapshot
Statistical physics of multicomponent alloys using KKR-CPA
inferredcites →https://doi.org/10.1103/physrevb.99.014206openalex-snapshot
Local order in Cr-Fe-Co-Ni: Experiment and electronic structure calculations
inferredcites →https://doi.org/10.1103/physrevlett.118.205501openalex-snapshot
Local Structure and Short-Range Order in a NiCoCr Solid Solution Alloy
inferredcites →https://doi.org/10.1103/physrevlett.124.046402openalex-snapshot
Extreme Fermi Surface Smearing in a Maximally Disordered Concentrated Solid Solution
inferredcites →https://doi.org/10.1103/physrevlett.127.115704openalex-snapshot
Martensitic Transformation in FexMn80−xCo10Cr10 High-Entropy Alloy
inferredcites →https://doi.org/10.1103/physrevlett.41.339openalex-snapshot
Complete Solution of the Korringa-Kohn-Rostoker Coherent-Potential-Approximation Equations: Cu-Ni Alloys
inferredcites →https://doi.org/10.1103/physrevlett.50.374openalex-snapshot
Concentration Waves and Fermi Surfaces in Random Metallic Alloys
inferredcites →https://doi.org/10.1103/physrevlett.66.766openalex-snapshot
Origins of compositional order in NiPt alloys
inferredcites →https://doi.org/10.1103/physrevmaterials.2.055004openalex-snapshot
Ta-Nb-Mo-W refractory high-entropy alloys: Anomalous ordering behavior and its intriguing electronic origin
inferredcites →https://doi.org/10.1103/physrevmaterials.3.075002openalex-snapshot
Tuning phase stability and short-range order through Al doping in (CoCrFeMn)100−xAlx high-entropy alloys
inferredcites →https://doi.org/10.1103/physrevx.5.011041openalex-snapshot
Criteria for Predicting the Formation of Single-Phase High-Entropy Alloys
inferredcites →https://doi.org/10.1103/revmodphys.73.515openalex-snapshot
Phonons and related crystal properties from density-functional perturbation theory
inferredcites →https://doi.org/10.1184/r1/6506957.v1openalex-snapshot
Hybrid Monte Carlo/Molecular Dynamics Simulation of a Refractory Metal High Entropy Alloy
inferredcites →https://doi.org/10.1557/jmr.2018.222openalex-snapshot
Modeling the structure and thermodynamics of high-entropy alloys
inferredcites →https://doi.org/10.3390/e18080403openalex-snapshot
Interplay between Lattice Distortions, Vibrations and Phase Stability in NbMoTaW High Entropy Alloys
inferredcites →https://doi.org/10.3390/e18090333openalex-snapshot
Design of Light-Weight High-Entropy Alloys
inferredcites →https://doi.org/10.3390/e20120899openalex-snapshot
About the Reliability of CALPHAD Predictions in Multicomponent Systems

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

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Introduction
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Atomic Short-Range Order and Phase Stability of the Refractory High-Entropy Alloys
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Complex, Multiphase Behaviour in the Ti$$_x$$NbMoTaW and Ti$$_x$$VNbMoTaW Refractory High-Entropy Alloys
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A Cautionary Tale: Treatment of the Magnetic State in the Cantor-Wu Alloys
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Summary, Conclusions, and Outlook
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Solute-strengthening in metal alloys with short-range order
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Frustrated metastable-to-equilibrium grain boundary structural transition in NbMoTaW due to segregation and chemical complexity
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Deciphering chemical ordering in High Entropy Materials: A machine learning-accelerated high-throughput cluster expansion approach
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Optimizing intrinsic strength–plasticity synergy for refractory high entropy alloy by chemical bonding engineering
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Solidification microstructures of V-Nb-Mo-Ta-W alloys: Insights from non-equiatomic alloys
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Interplay between Thermal Vacancy and Short-Range Order in Complex Concentrated Alloys
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Effect of order-disorder transition and lattice distortion on the mechanical properties of W-X (X = V, Nb, Ta) solid solutions
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Tailoring an ultrafine-grained VNbMoTaW refractory high entropy alloy with ultrahigh strength
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Enhanced strength-ductility synergy in W-containing high entropy alloy by hierarchical heterostructuring
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Off-stoichiometry on chemical short-range ordering in VNbMoTaW refractory high entropy alloys
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A review on recent progress of refractory high entropy alloys: From fundamental research to engineering applications
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Theoretical study on the element distribution characteristics and the effects of oxygen in TiZrHfNb high entropy alloys
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Inhibition effect of segregation and chemical order on grain boundary migration in NbMoTaW multi-principal element alloy
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Cooperative game during phase transformations in complex alloy systems
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A Free-Energy Upper-Bound Criterion for Entropy-Active Element Counts in High-Entropy Materials
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Integrated ab initio modelling of atomic ordering and magnetic anisotropy for design of FeNi-based magnets
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Structure, short-range order, and phase stability of the AlxCrFeCoNi high-entropy alloy: insights from a perturbative, DFT-based analysis
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Artificial intelligence-driven magnetic property prediction and materials discovery for next-generation spintronics
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Competition between phase ordering and phase segregation in the TixNbMoTaW and TixVNbMoTaW refractory high-entropy alloys
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Computational simulation of short-range order structures in high-entropy alloys: a review on formation patterns, multiscale characterization, and performance modulation mechanisms
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Emergent B2 chemical orderings in the AlTiVNb and AlTiCrMo refractory high-entropy superalloys studied via first-principles theory and atomistic modelling
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BraWl: Simulating the thermodynamics and phase stability of multicomponent alloys using conventional and enhanced sampling techniques
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