Three dimensional structures predicted by the modified phase field crystal equation / Bueno Jesus,Starodumov Ilya,Gomez Hector,Galenko Peter,Alexandrov Dmitri // COMPUTATIONAL MATERIALS SCIENCE. - 2016. - V. 111, l. . - P. 310-312.

ISSN/EISSN:
0927-0256 / 1879-0801
Type:
Article
Abstract:
We present the first numerical results on three dimensional structures predicted by the modified phase field crystal equation. The computations are performed using parallel algorithms based on isogeometric analysis, a generalization of the finite element method. The evolution of crystal structures to their steady equilibrium state is predicted for various atomic densities and temperatures. These steady structures are consistent with the phase diagram predicted earlier using one-mode approximations of analytical solutions to the classical parabolic phase-field crystal equation. (C) 2015 Elsevier B.V. All rights reserved.
Author keywords:
Phase field; Crystal; Isogeometric analysis; Parallel computing
DOI:
10.1016/j.commatsci.2015.09.03
Web of Science ID:
ISI:000364164400042
Соавторы в МНС:
Другие поля
Поле Значение
Month JAN
Publisher ELSEVIER SCIENCE BV
Address PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS
Language English
EISSN 1879-0801
Research-Areas Materials Science
Web-of-Science-Categories Materials Science, Multidisciplinary
Author-Email jesus.bueno@udc.es ilya.starodumov@urfu.ru
ResearcherID-Numbers Alexandrov, Dmitri/D-2516-2016
ORCID-Numbers Alexandrov, Dmitri/0000-0002-6628-745X
Funding-Acknowledgement European Research Council through the FP7 Ideas Starting Grant {[}307201]; Ministerio de Economia y Competitividad {[}DPI2013-44406-R]; FEDER funds; Russian Foundation for Basic Research (RFBR) {[}14-29-10282]; Ministry of Education and Science of the Russian Federation {[}315]
Funding-Text I.S. thanks the Ural Federal University for supporting a collaborative visit to University of A Coruna. H.G. was partially supported by the European Research Council through the FP7 Ideas Starting Grant (Project No. 307201) as well as by Ministerio de Economia y Competitividad (Project No. DPI2013-44406-R) cofinanced with FEDER funds. P.G. acknowledges the support from Russian Foundation for Basic Research (RFBR Project No. 14-29-10282). D.A. acknowledges support from the Ministry of Education and Science of the Russian Federation (Project No. 315).
Number-of-Cited-References 22
Usage-Count-Last-180-days 2
Usage-Count-Since-2013 14
Journal-ISO Comput. Mater. Sci.
Doc-Delivery-Number CV3MX