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ČERNÝ, M. ŠESTÁK, P. POKLUDA, J.
Original Title
First Principles Study of Ni-Ti Ordered Systems under Isotropic Loading
Type
conference paper
Language
English
Original Abstract
Aim of this work is first principles study of elastic response of Ni-Ti ordered systems on isotropic loading. All studied quantities are computed from total energy of system and its changes under applied deformation. Energies of well known Ni-Ti structures (particularly B2, B19 and B19') are compared with those of some hypothetical Ni-Ti systems. Possibility of magnetic ordering is taken into account using spin-polarized calculations.
Keywords
NiTi, ab initio, hydrostatic loading, theoretical strength
Authors
ČERNÝ, M.; ŠESTÁK, P.; POKLUDA, J.
RIV year
2005
Released
1. 1. 2005
Publisher
Vysoké učení technické v Brně, Fakulta strojního inženýrství
Location
Brno
ISBN
80-214-2984-4
Book
Juniormat'05
Pages from
167
Pages to
170
Pages count
4
BibTex
@inproceedings{BUT15239, author="Miroslav {Černý} and Petr {Šesták} and Jaroslav {Pokluda}", title="First Principles Study of Ni-Ti Ordered Systems under Isotropic Loading", booktitle="Juniormat'05", year="2005", pages="4", publisher="Vysoké učení technické v Brně, Fakulta strojního inženýrství", address="Brno", isbn="80-214-2984-4" }