Facet and energy predictions in grain boundaries: lattice matching and molecular dynamics
Fuente:
arXiv
Saved in:
| Main Authors: | Dobrovolski, Bruno, Owens, C. Braxton, Hart, Gus L. W., Homer, Eric R., Runnels, Brandon |
|---|---|
| Format: | Preprint |
| Published: |
2023
|
| Subjects: | |
| Online Access: | |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
Similar Items
Examination of computed aluminum grain boundary structures and interface energies that span the 5D space of crystallographic character
by: Homer, Eric R., et al.
Published: (2022)
by: Homer, Eric R., et al.
Published: (2022)
Mechanics of incompatible asymmetric grain boundary migration
by: Runnels, Brandon
Published: (2026)
by: Runnels, Brandon
Published: (2026)
Grain boundary solute segregation across the 5D space of crystallographic character
by: Serafin, Lydia Harris, et al.
Published: (2024)
by: Serafin, Lydia Harris, et al.
Published: (2024)
Can we predict mixed grain boundaries from their tilt and twist components?
by: Wan, Wei, et al.
Published: (2024)
by: Wan, Wei, et al.
Published: (2024)
A taxonomy of grain boundary migration mechanisms via displacement texture characterization
by: Chesser, Ian, et al.
Published: (2021)
by: Chesser, Ian, et al.
Published: (2021)
Decomposition of low-angle grain boundaries
by: Wan, Wei, et al.
Published: (2025)
by: Wan, Wei, et al.
Published: (2025)
Energetics of the nucleation and glide of disconnection modes in symmetric tilt grain boundaries
by: Joshi, Himanshu, et al.
Published: (2025)
by: Joshi, Himanshu, et al.
Published: (2025)
Describe, Transform, Machine Learning: Feature Engineering for Grain Boundaries and Other Variable-Sized Atom Clusters
by: Owens, C. Braxton, et al.
Published: (2024)
by: Owens, C. Braxton, et al.
Published: (2024)
Finite-temperature grain boundary properties from quasistatic atomistics
by: Spínola, Miguel, et al.
Published: (2024)
by: Spínola, Miguel, et al.
Published: (2024)
Grain boundary network plasticity: reduced-order modeling of deformation-driven microstructure evolution
by: Bugas, Daniel, et al.
Published: (2023)
by: Bugas, Daniel, et al.
Published: (2023)
Faceting transition in aluminum as a grain boundary phase transition
by: Choi, Yoonji, et al.
Published: (2025)
by: Choi, Yoonji, et al.
Published: (2025)
Atomistic-informed phase field modeling of magnesium twin growth by disconnections
by: Hu, Yang, et al.
Published: (2024)
by: Hu, Yang, et al.
Published: (2024)
Relative Grain Boundary Energies from Triple Junction Geometry: Limitations to Assuming the Herring Condition in Nanocrystalline Thin Films
by: Patrick, Matthew J., et al.
Published: (2022)
by: Patrick, Matthew J., et al.
Published: (2022)
On a relationship between grain boundary free energy, grain boundary segregation, and grain boundary diffusion
by: Mishin, Yuri
Published: (2026)
by: Mishin, Yuri
Published: (2026)
Impact of grain boundary energy anisotropy on grain growth
by: Naghibzadeh, S. Kiana, et al.
Published: (2024)
by: Naghibzadeh, S. Kiana, et al.
Published: (2024)
Predicting void nucleation in microstructure with convolutional neural networks
by: Anantharanga, Abhijith Thoopul, et al.
Published: (2025)
by: Anantharanga, Abhijith Thoopul, et al.
Published: (2025)
On modeling global grain boundary energy functions
by: Morawiec, Adam
Published: (2025)
by: Morawiec, Adam
Published: (2025)
A phase field model with arbitrary misorientation dependence of grain boundary energy
by: Staublin, Philip, et al.
Published: (2026)
by: Staublin, Philip, et al.
Published: (2026)
The structure and migration of twin boundaries in tetragonal $β$-Sn: an application of machine learning based interatomic potentials
by: Chesser, Ian, et al.
Published: (2025)
by: Chesser, Ian, et al.
Published: (2025)
Grand canonically optimized grain boundary phases in hexagonal close-packed titanium
by: Chen, Enze, et al.
Published: (2024)
by: Chen, Enze, et al.
Published: (2024)
Fundamental Microscopic Properties as Predictors of Large-Scale Quantities of Interest: Validation through Grain Boundary Energy Trends
by: Jasperson, Benjamin A., et al.
Published: (2024)
by: Jasperson, Benjamin A., et al.
Published: (2024)
A unified variational model for grain boundary dynamics incorporating microscopic structure
by: Zhang, Luchan, et al.
Published: (2024)
by: Zhang, Luchan, et al.
Published: (2024)
Neutron scattering studies of complex lattice dynamics in energy materials
by: Ren, Qingyong, et al.
Published: (2025)
by: Ren, Qingyong, et al.
Published: (2025)
How accurate are simulations and experiments for the lattice energies of molecular crystals?
by: Della Pia, Flaviano, et al.
Published: (2024)
by: Della Pia, Flaviano, et al.
Published: (2024)
Polyepitaxial grain matching to study the oxidation of uranium dioxide
by: Wasik, Jacek, et al.
Published: (2024)
by: Wasik, Jacek, et al.
Published: (2024)
Sensitivity of grain-averaged elastic strain and orientation predictions on the mesh density and boundary conditions in crystal plasticity finite element simulations
by: Lethoba, Jeremiah, et al.
Published: (2026)
by: Lethoba, Jeremiah, et al.
Published: (2026)
Quasi-aperiodic grain boundary phases of Σ5 tilt grain boundaries in refractory metals
by: Chen, Enze, et al.
Published: (2025)
by: Chen, Enze, et al.
Published: (2025)
Bulk nanocrystalline Al-Mg-Y alloys with amorphous grain boundary complexions display high strength and compressive plasticity
by: Lei, Tianjiao, et al.
Published: (2025)
by: Lei, Tianjiao, et al.
Published: (2025)
X-ray induced grain boundary formation and grain rotation in Bi2Se3
by: Katagiri, Kento, et al.
Published: (2024)
by: Katagiri, Kento, et al.
Published: (2024)
Anharmonic lattice dynamics study of phonon transport in layered and molecular-crystal indium iodides
by: Shiga, Takuma, et al.
Published: (2026)
by: Shiga, Takuma, et al.
Published: (2026)
Learning from metastable grain boundaries
by: Mishra, Avanish, et al.
Published: (2024)
by: Mishra, Avanish, et al.
Published: (2024)
Topological grain boundary segregation transitions
by: Devulapalli, Vivek, et al.
Published: (2024)
by: Devulapalli, Vivek, et al.
Published: (2024)
Element-specific ultrafast lattice dynamics in monolayer WSe2
by: Jung, H., et al.
Published: (2024)
by: Jung, H., et al.
Published: (2024)
Parameter-free prediction of irradiation defect structures in tungsten at room temperature using stochastic cluster dynamics
by: He, Sicong, et al.
Published: (2025)
by: He, Sicong, et al.
Published: (2025)
Grain boundary energy models and boundary splitting
by: Morawiec, Adam
Published: (2025)
by: Morawiec, Adam
Published: (2025)
Self-pinning mechanism for grain boundary stabilization
by: Hussein, Omar, et al.
Published: (2026)
by: Hussein, Omar, et al.
Published: (2026)
Mircomechanical insights into unconstrained grain boundary sliding
by: Bandla, Divya Sri, et al.
Published: (2026)
by: Bandla, Divya Sri, et al.
Published: (2026)
Iterative learning scheme for crystal structure prediction with anharmonic lattice dynamics
by: Gao, Hao, et al.
Published: (2025)
by: Gao, Hao, et al.
Published: (2025)
Decomposition of general grain boundaries
by: Wan, Wei, et al.
Published: (2025)
by: Wan, Wei, et al.
Published: (2025)
Role of defects in the thermodynamic stability of grain boundary phases at asymmetric tilt boundaries in copper
by: Pemma, Swetha, et al.
Published: (2026)
by: Pemma, Swetha, et al.
Published: (2026)
Similar Items
-
Examination of computed aluminum grain boundary structures and interface energies that span the 5D space of crystallographic character
by: Homer, Eric R., et al.
Published: (2022) -
Mechanics of incompatible asymmetric grain boundary migration
by: Runnels, Brandon
Published: (2026) -
Grain boundary solute segregation across the 5D space of crystallographic character
by: Serafin, Lydia Harris, et al.
Published: (2024) -
Can we predict mixed grain boundaries from their tilt and twist components?
by: Wan, Wei, et al.
Published: (2024) -
A taxonomy of grain boundary migration mechanisms via displacement texture characterization
by: Chesser, Ian, et al.
Published: (2021)