Publication result detail

First Principles Study of Ni-Ti Ordered Systems under Isotropic Loading

ČERNÝ, M.; ŠESTÁK, P.; POKLUDA, J.

Original Title

First Principles Study of Ni-Ti Ordered Systems under Isotropic Loading

English Title

First Principles Study of Ni-Ti Ordered Systems under Isotropic Loading

Type

Paper in proceedings (conference paper)

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.

English 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

Key words in English

NiTi, ab initio, hydrostatic loading, theoretical strength

Authors

ČERNÝ, M.; ŠESTÁK, P.; POKLUDA, J.

Released

01.01.2005

Publisher

Vysoké učení technické v Brně, Fakulta strojního inženýrství

Location

Brno

ISBN

80-214-2984-4

Book

Juniormat'05

Pages from

167

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"
}