Atomistic insights into solid solution strengthening: size misfit versus stiffness misfit

Authors: Liang, Aoyan, Bertin, Nicolas, Zhou, Xinran, Aubry, Sylvie, Bulatov, Vasily V.

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/2502.19637

An information-matching approach to optimal experimental design and active learning

Authors: Kurniawan, Yonatan, Neilsen, Tracianne B., Francis, Benjamin L., Stankovic, Alex M., Wen, Mingjian, Nikiforov, Ilia, Tadmor, Ellad B., Bulatov, Vasily V., Lordi, Vincenzo, Transtrum, Mark K.

Subject Terms: Computer Science - Machine Learning, Condensed Matter - Materials Science, Physics - Applied Physics, Physics - Computational Physics, Physics - Data Analysis, Statistics and Probability

Access URL: http://arxiv.org/abs/2411.02740

Cross-scale covariance for material property prediction

Authors: Jasperson, Benjamin A., Nikiforov, Ilia, Samanta, Amit, Zhou, Fei, Tadmor, Ellad B., Lordi, Vincenzo, Bulatov, Vasily V.

Source: npj.Comput.Mater. 11 (2025) 1

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/2406.05146

Learning dislocation dynamics mobility laws from large-scale MD simulations

Authors: Bertin, Nicolas, Bulatov, Vasily V., Zhou, Fei

Subject Terms: Condensed Matter - Materials Science, Computer Science - Machine Learning, Physics - Computational Physics

Access URL: http://arxiv.org/abs/2309.14450

Network aspects of single crystal plasticity

Authors: Bulatov, Vasily V. ^{a, ⁎}, Bertin, Nicolas ^a, Aubry, Sylvie ^a, Zepeda-Ruiz, Luis A. ^a, Zhou, Xinran ^{a, b, c}, Liang, Aoyan ^d, Oppelstrup, Tomas ^a, Sadigh, Babak ^a, Arsenlis, Athanasios ^a, Austin, Ryan ^a, Carson, Robert ^a, Barton, Nathan R. ^a

Source: In Journal of Materials Research and Technology May-June 2025 36:5611-5619

Enhanced mobility of dislocation network nodes and its effect on dislocation multiplication and strain hardening

Authors: Bertin, Nicolas, Cai, Wei, Aubry, Sylvie, Arsenlis, Athanasios, Bulatov, Vasily V.

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/2210.14343

Energy storage under high-rate compression of single crystal tantalum

Authors: Stimac, Jared C., Bertin, Nicolas, Mason, Jeremy K., Bulatov, Vasily V.

Subject Terms: Condensed Matter - Materials Science, Physics - Computational Physics

Access URL: http://arxiv.org/abs/2205.04653

Enhanced mobility of dislocation network nodes and its effect on dislocation multiplication and strain hardening

Authors: Bertin, Nicolas, Cai, Wei, Aubry, Sylvie, Arsenlis, Athanasios, Bulatov, Vasily V.

Source: In Acta Materialia 1 June 2024 271

Metal hardening in atomistic detail

Authors: Zepeda-Ruiz, Luis A., Stukowski, Alexander, Oppelstrup, Tomas, Bertin, Nicolas, Barton, Nathan R., Freitas, Rodrigo, Bulatov, Vasily V.

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/1909.02030

Crystal plasticity model of BCC metals from large-scale MD simulations

Authors: Bertin, Nicolas, Carson, Robert, Bulatov, Vasily V., Lind, Jonathan, Nelms, Matthew

Source: In Acta Materialia 1 November 2023 260

Quantum effects on dislocation motion from Ring-Polymer Molecular Dynamics

Authors: Freitas, Rodrigo, Asta, Mark, Bulatov, Vasily V.

Source: nature partner journal: Computational Materials, volume 4, Article number: 55 (2018)

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/1712.04629

Probing the ultimate limits of metal plasticity

Authors: Zepeda-Ruiz, Luis A., Stukowski, Alexander, Oppelstrup, Tomas, Bulatov, Vasily V.

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/1604.06408

Cross-scale covariance for material property prediction.

Authors: Jasperson, Benjamin A., Nikiforov, Ilia, Samanta, Amit, Zhou, Fei, Tadmor, Ellad B., Lordi, Vincenzo, Bulatov, Vasily V.

Source: NPJ Computational Materials; 1/4/2025, Vol. 11 Issue 1, p1-8, 8p

Subject Terms: MATHEMATICAL statistics, STATISTICAL errors, REGRESSION analysis, MOLECULAR dynamics, FORECASTING

Computationally-efficient stochastic cluster dynamics method for modeling damage accumulation in irradiated materials

Authors: Hoang, Tuan L., Marian, Jaime, Bulatov, Vasily V., Hosemann, Peter

Subject Terms: Computer Science - Data Structures and Algorithms

Access URL: http://arxiv.org/abs/1412.0640

Path Factorization Approach to Stochastic Simulations

Authors: Athènes, Manuel, Bulatov, Vasily V.

Source: Physical Review Letters 113, 230601 (2014)

Subject Terms: Condensed Matter - Statistical Mechanics, 05D40, 37A60, J.2, G.3, G.1.3

Access URL: http://arxiv.org/abs/1403.2282

Anisotropy of Interfacial Energy in Five Dimensions

Authors: Bulatov, Vasily V., Reed, Bryan W., Kumar, Mukul

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/1305.1282

Dynamical Effects of Driven Dislocation Glide through Local Pinnings

Authors: Hiratani, Masato, Bulatov, Vasily V.

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/cond-mat/0509527

A nonplanar Peierls-Nabarro model and its applications to dislocation cross-slip

Authors: Lu, Gang, Bulatov, Vasily V., Kioussis, Nicholas

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/cond-mat/0208440

Dislocation constriction and cross-slip in Al and Ag: an ab initio study

Authors: Lu, Gang, Bulatov, Vasily V., Kioussis, Nicholas

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/cond-mat/0202488

A Critical Reexamination of the Peierls-Nabarro Model

Authors: Lu, Gang, Kioussis, Nicholas, Bulatov, Vasily V., Kaxiras, Efthimios

Subject Terms: Condensed Matter - Materials Science

Access URL: http://arxiv.org/abs/cond-mat/9907352