Ab initio DFT study of ideal strength of crystal and surfaces in covalent systems

Materials Research Society Symposium Proceedings

Volumn 1086, Issue , 2008, Pages 43-48

  Umeno, Yoshitaka ^a  

^a INSTITUTE OF INDUSTRIAL SCIENCE   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; DENSITY FUNCTIONAL THEORY; NUCLEATION; SHEAR FLOW; SILICON CARBIDE; SILICON COMPOUNDS;

AB-INITIO DENSITY FUNCTIONAL THEORY CALCULATIONS (DFT); COVALENT CRYSTALS; DISLOCATION NUCLEATION; IDEAL SHEAR STRENGTH; IDEAL TENSILE STRENGTHS; MULTI-AXIAL LOADINGS; NUCLEATION SITES; THEORETICAL TENSILE STRENGTHS;

TENSILE STRENGTH;

EID: 70350765008     PISSN: 02729172     EISSN: None     Source Type: Conference Proceeding    
DOI: 10.1557/proc-1086-u07-03     Document Type: Conference Paper

References (5)

1. T. Kitamura, Y. Umeno and A. Kushima, Mater. Sci. Forum 482, 25-32 (2005).
2. G. Kresse and J. Furthmueller, Phys. Rev. B 54, 11169-11186 (1996).
3. Y.A. Abramov and F.P. Okamura, Acta Cryst. A 53, 187-198 (1997).
4. D. Roundy and M.L. Cohen, Phys. Rev. B 64, 212103 (2001).
5. S. Ogata, private communication.