Show/Hide Menu
Hide/Show Apps
Logout
Türkçe
Türkçe
Search
Search
Login
Login
OpenMETU
OpenMETU
About
About
Open Science Policy
Open Science Policy
Communities & Collections
Communities & Collections
Help
Help
Frequently Asked Questions
Frequently Asked Questions
Guides
Guides
Thesis submission
Thesis submission
MS without thesis term project submission
MS without thesis term project submission
Publication submission with DOI
Publication submission with DOI
Publication submission
Publication submission
Supporting Information
Supporting Information
General Information
General Information
Copyright, Embargo and License
Copyright, Embargo and License
Contact us
Contact us
Mechanical and lattice dynamical properties of the Re2C compound
Date
2010-12-01
Author
Ozisik, Haci
Deligoz, Engin
Colakoglu, Kemal
Sürücü, Gökhan
Metadata
Show full item record
This work is licensed under a
Creative Commons Attribution-NonCommercial-NoDerivatives 4.0 International License
.
Item Usage Stats
29
views
0
downloads
Cite This
In this work density functional theory calculations on the shear products. Young modulus, poisssons ratio, hardness, structural mechanical and dynamical properties of Debye temperature and sound develocities of this compound. Re2C without B-type structure are reported. The general Furthermore the band structure phonon disperssion curvesized gadient approximation has been used for modeling and corresponding density of states are computed. The ob-change-correlation effects. We have predicted the latice and results are in good agreement with the available ex-constants bulk modulus bond distances elastic constants permiental and other theoritical data. (C) 2010 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim
URI
https://hdl.handle.net/11511/88988
Journal
PHYSICA STATUS SOLIDI-RAPID RESEARCH LETTERS
DOI
https://doi.org/10.1002/pssr.201004397
Collections
Department of Physics, Article
Suggestions
OpenMETU
Core
Structural, electronic, elastic, thermodynamic and vibration properties of TbN compound from first principles calculations
ÇİFTCİ, YASEMİN; Ozayman, M.; Sürücü, Gökhan; Colakoglu, K.; Deligoz, E. (2012-03-01)
We have predicted structural, electronic, elastic, thermodynamic and vibration characteristics of TbN, using density functional theory within generalized-gradient (GGA) apraximation. For the total energy calculation we have used the projected augmented plane-wave (PAW) implementation of the Vienna Ab initio Simulation Package (VASP). We have used to examine structure parameter in eight different structures such as in NaCl (B1), CsCl (B2), ZB (B3), Tetragonal (L1(0)), WC (Bh), NiAs (B8), PbO (B10) and Wurtzi...
Elastic analysis of orthotropic cylinders under different boundary conditions
Farukoğlu, Ömer Can; Eraslan, Ahmet Nedim; Department of Engineering Sciences (2016)
Analytical solutions are derived to examine the elastic responses of fixed end cylinders made of orthotropic materials. Cylinders are investigated under different boundary conditions which are internal pressure, external pressure, combined pressure and annular rotation respectively. Making use of Maxwell relations, orthotropic cylinders are transformed to isotropic ones. In order to exhibit numerical examples different orthotropic materials are used and compared. It is observed that orthotrophy slightly inf...
Mechanical and phonon properties of the superhard LuB2, LuB4, and LuB12 compounds
Deligoz, E.; Ozisik, H.; Colakoglu, K.; Sürücü, Gökhan; ÇİFTCİ, YASEMİN (2011-02-01)
We have studied structural, elastic, and lattice dynamical properties of the LuB2, LuB4, and LuB12 compounds by using the plane-wave pseudopotential approach to the density-functional theory within the generalized gradient approximation. We have considered three different crystal structures of LuBx: LuB2 (P6/mmm), LuB4 (P4/mbm), and LuB12 (Fm-3m). The most stable structure is found to be tetragonal (P4/mbm) structure. The comparative results on the basic physical parameters such as lattice constants, bulk m...
Electronic and structural properties of armchair SWCNT/TiO2(110)-(1 x 2) system
Tayran, C.; ÇAKMAK, MELEK; Elliatioglu, S. (Elsevier BV, 2011-03-01)
We have presented structural and electronic properties of single-walled carbon nanotubes (CNTs) with armchair chirality on the reconstructed rutile TiO2(110)-(1 x 2) surface by means of ab initio calculations using density functional theory. For the TiO2 surface reconstruction, we have adopted an added-row model which was experimentally proposed in parallel to STM patterns and theoretically agreed by first principle calculations. In this work, we have studied, as examples, two CNTs with different sizes, (3,...
Structural and electronic properties of InmSen microclusters: density functional theory calculations
Erkoc, S; Katırcıoğlu, Şenay; Yilmaz, T (2001-06-15)
We have investigated the structural and electronic properties of isolated InmSen microclusters for m + n less than or equal to 4 by performing density functional theory calculations. We have obtained the optimum geometries, possible dissociation channels and the electronic structure of the clusters considered.
Citation Formats
IEEE
ACM
APA
CHICAGO
MLA
BibTeX
H. Ozisik, E. Deligoz, K. Colakoglu, and G. Sürücü, “Mechanical and lattice dynamical properties of the Re2C compound,”
PHYSICA STATUS SOLIDI-RAPID RESEARCH LETTERS
, pp. 347–349, 2010, Accessed: 00, 2021. [Online]. Available: https://hdl.handle.net/11511/88988.