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Dislocation core chemistry in oxides critically influences mechanical behavior and functionality; yet the evolution of core chemistry during the dislocation motion in them has not been directly observed. Here, using SrTiO3 as a model…

Materials Science · Physics 2026-05-04 Min-Chul Kang , Chunxu Yan , Alexander Frisch , Xufei Fang , Liming Xiong , Lin Zhou

Dislocations in perovskite oxides have important impacts on their physical and chemical properties, which are determined by their unique atomic environments. In the present study, the structure of dislocations in a 10{\deg} low-angle grain…

Materials Science · Physics 2020-01-08 Xujing Li , Shulin Chen , Mingqiang Li , Jingmin Zhang , Xiumei Ma , Kaihui Liu , Xuedong Bai , Peng Gao

Dislocations in ceramics at room temperature are attracting increasing research interest. Dislocations may bring a new perspective for tuning physical and mechanical properties in advanced ceramics. Here, we investigate the dislocation…

Materials Science · Physics 2025-04-09 Jiawen Zhang , Xufei Fang , Wenjun Lu

Dislocations in perovskite oxides have drawn increasing research interest due to their potential of tuning functional properties of electroceramics. Open questions remain regarding the behavior of dislocations concerning their stability…

Materials Science · Physics 2025-12-04 Alexander Frisch , Daniel Isaia , Oliver Preuß , Xufei Fang

By using the state-of-the-art microscopy and spectroscopy in aberration-corrected scanning transmission electron microscopes, we determine the atomic arrangements, occupancy, elemental distribution, and the electronic structures of…

Materials Science · Physics 2017-05-10 Peng Gao , Ryo Ishikawa , Bin Feng , Akihito Kumamoto , Naoya Shibata , Yuichi Ikuhara

Plasticity in hexagonal close-packed zirconium is mainly controlled by the glide of dislocations with 1/3<1-210> Burgers vectors. As these dislocations cannot accommodate deformation in the [0001] direction , twinning or glide of <c+a>…

Materials Science · Physics 2020-09-07 Thomas Soyez , Daniel Caillard , Fabien Onimus , Emmanuel Clouet

Plasticity in zirconium is controlled by 1/3<1-210> screw dislocations gliding in the prism planes of the hexagonal close-packed structure. This prismatic and not basal glide is observed for a given set of transition metals like zirconium…

Materials Science · Physics 2012-10-04 Emmanuel Clouet

Modern functional oxides are mainly engineered by doping, essentially by tuning the defect chemistry. Recent studies suggest that dislocations offer a new perspective for enhancing the mechanical and physical properties of ceramic oxides.…

Bodies in relative motion separated by a gap of a few nanometers can experience a tiny friction force. This non-contact dissipation can have various origins and can be successfully measured by a sensitive pendulum atomic force microscope…

Strongly Correlated Electrons · Physics 2018-09-17 Marcin Kisiel , Oleg O. Brovko , Dilek Yildiz , Remy Pawlak , Urs Gysin , Erio Tosatti , Ernst Meyer

The classical motion of gliding dislocation lines in slip planes of crystalline solid helium leads to plastic deformation even at temperatures far below the Debye temperature and can affect elastic properties. In this work we argue that the…

Dislocation engineering has the potential to open new avenues toward the exploration and modification of the properties of quantum materials. Strontium titanate (SrTiO3, STO) and potassium tantalate (KTaO3, KTO) are incipient ferroelectrics…

The interaction between screw dislocations and oxygen interstitial atoms is studied with ab initio calculations in hexagonal close-packed titanium. Our calculations evidence a strong repulsion when the solute atoms are located in the…

Materials Science · Physics 2018-11-27 Nermine Chaari , David Rodney , Emmanuel Clouet

Although titanium nitride (TiN) is among the most extensively studied and thoroughly characterized thin-film ceramic materials, detailed knowledge of relevant dislocation core structures is lacking. By high-resolution scanning transmission…

Plasticity in hexagonal close-packed zirconium is controlled by screw dislocations which easily glide in the prismatic planes where they are dissociated. At high enough temperatures, these dislocations can deviate out of the prism planes to…

Materials Science · Physics 2021-12-09 Émile Maras , Emmanuel Clouet

Plasticity in hexagonal close packed (HCP) metals and alloys such as Titanium (Ti) and Zirconium (Zr) is carried out by the motion of $\langle a \rangle$ dislocations. Above room temperature, in situ transmission electron microscopy…

Materials Science · Physics 2023-10-25 Ali Rida , Satish I. Rao , Jaafar A. El-Awady

For potentially wider applications of ceramics with dislocation-tuned mechanical and functional properties, it is pertinent to achieve dislocation engineering in polycrystalline ceramics. However, grain boundaries (GBs) in general are…

Materials Science · Physics 2025-09-08 Kuan Ding , Atsutomo Nakamura , Patrick Cordier , Xufei Fang

Atomic crystals with dislocations deform plastically at low stresses via dislocation glide. Whether dislocation glide occurs in macroscopic frictional granular media has remained unknown. The discrete element method is employed to simulate…

Materials Science · Physics 2026-05-26 Fumiaki Nakai , Takashi Uneyama , Yuto Sasaki , Kiwamu Yoshii , Hiroaki Katsuragi

Potassium tantalate KTaO3 is a cubic, paraelectric perovskite ceramic that exhibits surprising ductility at room temperature as most recently reported. Much like strontium titanate (SrTiO3), plastic deformation is accommodated by…

Materials Science · Physics 2025-02-05 Pierre Hirel , Franck Junior Kakdeu Yewou , Jiawen Zhang , Wenjun Lu , Xufei Fang , Philippe Carrez

Basal slip acts as a secondary deformation mode in hexagonal close-packed titanium and becomes one of the primary mechanisms in titanium alloyed with simple metals. As these solute elements also lead to a pronounced reduction of the energy…

Materials Science · Physics 2019-09-27 Piotr Kwasniak , Emmanuel Clouet

Atomic-scale calculations for the dynamics of the 90$^0$ partial glide dislocation in silicon are made using the effective-medium tight-binding theory. Kink formation and migration energies for the reconstructed partial dislocation are…

Materials Science · Physics 2008-02-03 K. Stokbro , L. B. Hansen , B. I. Lundqvist
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