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A DFT investigation of electronic, elastic, and thermal properties of 3d transition metal carbides –TMC (TM = Sc–Zn)

  • Published:2020-12 Issue: Volume:25 Page:e00500
  • ISSN:2352-2143
  • Container-title:Computational Condensed Matter
  • language:en
  • Short-container-title:Computational Condensed Matter

Author:

Priyanka D ShobanaORCID,Sirajuddeen M. Mohamed Sheik,Elavarasi S. Begam

Publisher

Elsevier BV

Subject

Materials Chemistry,Condensed Matter Physics,Materials Science (miscellaneous),Electronic, Optical and Magnetic Materials

Reference56 articles.

1. Transition Metal Carbides and Nitrides;Toth,1971

2. Structural phase transition in layered transition metal compounds;Calais;Adv. Phys.,1977

3. Recent investigations on electronic structure of the fourth and fifth group transition metal monocarbides, mononitrides and mono oxides;Neckel;Int. J. Quant. Chem.,1983

4. Structural, electronic and thermal properties of TiC compound in sodium chloride structure;O Musa;Iraq. J. Applied Phys.,2015

5. Modeling and characterization of V4C3 precipitation and cementite dissolution during tempering of Fe-C-V martensitic steel;Yamasaki;J. Mater. Sci. Technol.,2003

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