Electronic Origins of Anomalous Twin Boundary Energies in Hexagonal Close Packed Transition Metals

Twin boundary interactions with grain boundaries investigated in pure rhenium

(2014) Josh Kacher et al.   ACTA MATERIALIA

Ultrahard nanotwinned cubic boron nitride

(2013) Yongjun Tian et al.   NATURE

Size versus electronic factors in transition metal carbide and TCP phase stability

(2013) D.G. Pettifor et al.   PHILOSOPHICAL MAGAZINE

Periodic Segregation of Solute Atoms in Fully Coherent Twin Boundaries

(2013) J. F. Nie et al.   SCIENCE

First-principles study of the structural and elastic properties of rhenium-based transition-metal alloys

(2012) Maarten de Jong et al.   PHYSICAL REVIEW B

Roulette-wheel selection via stochastic acceptance

(2011) Adam Lipowski et al.   PHYSICA A-STATISTICAL MECHANICS AND ITS APPLICATIONS

First-principles study of dislocations in hcp metals through the investigation of the (112¯1) twin boundary

(2011) Nina J. Lane et al.   PHYSICAL REVIEW B

Theory of structural trends within4dand5dtransition metal topologically close-packed phases

(2011) B. Seiser et al.   PHYSICAL REVIEW B

Calculating condensed matter properties using the KKR-Green's function method—recent developments and applications

(2011) H Ebert et al.   REPORTS ON PROGRESS IN PHYSICS

Effect of Rhenium on the Dislocation Core Structure in Tungsten

(2010) Lorenz Romaner et al.   PHYSICAL REVIEW LETTERS

A probabilistic twin nucleation model for HCP polycrystalline metals

(2010) I. J. Beyerlein et al.   PROCEEDINGS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES

Survey of computed grain boundary properties in face-centered cubic metals: I. Grain boundary energy

(2009) David L. Olmsted et al.   ACTA MATERIALIA

Atomistic modelling of materials with bond-order potentials

(2009) Thomas Hammerschmidt et al.   International Journal of Materials Research

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

(2009) Paolo Giannozzi et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Strengthening Materials by Engineering Coherent Internal Boundaries at the Nanoscale

(2009) K. Lu et al.   SCIENCE

Nucleation and stability of twins in hcp metals

(2008) L. Capolungo et al.   PHYSICAL REVIEW B