Atomistic modeling of long-term evolution of twist boundaries under vacancy supersaturation

Structure of a 2∘(010) Cu twist boundary interface and the segregation of vacancies and He atoms

(2012) Enrique Martínez et al.   PHYSICAL REVIEW B

Atomic-scale design of radiation-tolerant nanocomposites

(2011) M. J. Demkowicz et al.   MRS BULLETIN

Are Nanoporous Materials Radiation Resistant?

(2011) E. M. Bringa et al.   NANO LETTERS

Growth mechanisms forTiO2at its rutile (110) surface

(2011) L. Vernon et al.   PHYSICAL REVIEW B

Simulating complex atomistic processes: On-the-fly kinetic Monte Carlo scheme with selective active volumes

(2011) Haixuan Xu et al.   PHYSICAL REVIEW B

Further development of large-scale atomistic modelling techniques for Fe–Cr alloys

(2010) D. Terentyev et al.   JOURNAL OF NUCLEAR MATERIALS

Modeling Microstructure and Irradiation Effects

(2010) C. S. Becquart et al.   METALLURGICAL AND MATERIALS TRANSACTIONS A-PHYSICAL METALLURGY AND MATERIALS SCIENCE

Extracting dislocations and non-dislocation crystal defects from atomistic simulation data

(2010) Alexander Stukowski et al.   MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING

Visualization and analysis of atomistic simulation data with OVITO–the Open Visualization Tool

(2009) Alexander Stukowski   MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING

Early stages ofα−α′phase separation in Fe-Cr alloys: An atomistic study

(2009) G. Bonny et al.   PHYSICAL REVIEW B

Kinetics of heterogeneous grain boundary precipitation of NbC in α-iron: A Monte Carlo study

(2008) C. Hin et al.   ACTA MATERIALIA

The Fe–Cr system: atomistic modelling of thermodynamics and kinetics of phase transformations

(2008) Duc Nguyen-Manh et al.   COMPTES RENDUS PHYSIQUE

Adaptive kinetic Monte Carlo for first-principles accelerated dynamics

(2008) Lijun Xu et al.   JOURNAL OF CHEMICAL PHYSICS

Kinetics of self-interstitial cluster aggregation near dislocations and their influence on hardening

(2008) Ming Wen et al.   JOURNAL OF NUCLEAR MATERIALS

Kinetic activation-relaxation technique: An off-lattice self-learning kinetic Monte Carlo algorithm

(2008) Fedwa El-Mellouhi et al.   PHYSICAL REVIEW B