Detail publikace

Ab initio calculations of ideal tensile strength and mechanical stability in copper

ČERNÝ, M. ŠOB, M. POKLUDA, J. ŠANDERA, P.

Anglický název

Ab initio calculations of ideal tensile strength and mechanical stability in copper

Typ

Článek recenzovaný mimo WoS a Scopus

Jazyk

en

Originální abstrakt

Simulation of a tensile test of~copper crystal along the [001] direction is performed using the Vienna ab initio simulation package (VASP). Stability conditions for uniaxially loaded system are presented and analysed and the ideal (theoretical) tensile strength for the loading along the [001] direction is determined to be 9.4 GPa in tension and 3.5 GPa in compression. A comparison with experimental values is performed.

Klíčová slova anglicky

ab initio, elastic stability, theoretical strength, copper, uniaxial loading

Vydáno

2004-02-06

ISSN

0953-8984

Časopis

JOURNAL OF PHYSICS-CONDENSED MATTER

Ročník

16

Číslo

2

Strany od–do

1045–

Počet stran

8

BIBTEX


@article{BUT42029,
  author="Miroslav {Černý} and Mojmír {Šob} and Jaroslav {Pokluda} and Pavel {Šandera}",
  title="Ab initio calculations of ideal tensile strength and mechanical stability in copper",
  journal="JOURNAL OF PHYSICS-CONDENSED MATTER",
  year="2004",
  volume="16",
  number="2",
  pages="8",
  issn="0953-8984"
}