Microscopic Mechanism of Doping-Induced Kinetically Constrained Crystallization in Phase-Change Materials.
Change log
Authors
Lee, Tae Hoon
Loke, Desmond
Elliott, Stephen R
Abstract
A comprehensive microscopic mechanism of doping-induced kinetically constrained crystallization in phase-change materials is provided by investigating structural and dynamical dopant characteristics via ab initio molecular dynamics simulations. The information gained from this study may provide a basis for a fast screening of dopant species for electronic memory devices, or for understanding the general physics involved in the crystallization of doped glasses.
Description
Keywords
DFT calculations, doping, kinetically constrained crystallization, phase-change materials, structural heterogeneity
Journal Title
Adv Mater
Conference Name
Journal ISSN
0935-9648
1521-4095
1521-4095
Volume Title
27
Publisher
Wiley
Publisher DOI
Sponsorship
Engineering and Physical Sciences Research Council (EP/I018050/1)
We acknowledge financial support from the Engineering and Physical Sciences Research Council (UK).