Publication Date:
2011-02-24
Description:
Author(s): Pavel Marton, Takahiro Shimada, Takayuki Kitamura, and Christian Elsässer Structures and energies of stoichiometric Σ3(111)[1 [over ¯] 10], Σ3(112)[1 [over ¯] 10], Σ5(201)[010], and Σ5(301)[010] symmetrical tilt grain boundaries are determined in the tetragonal ferroelectric PbTiO_{3} using a combination of first-principles electronic-structure calculations and atom... [Phys. Rev. B 83, 064110] Published Wed Feb 23, 2011
Keywords:
Structure, structural phase transitions, mechanical properties, defects
Print ISSN:
1098-0121
Electronic ISSN:
1095-3795
Topics:
Physics
Permalink