First principle investigation of mercury chalcogenides and their HgSxSe1−x and HgSxTe1−x ternary alloys

Computational Materials Science ◽

10.1016/j.commatsci.2013.10.044 ◽

2014 ◽

Vol 83 ◽

pp. 107-113 ◽

Author(s):

B. Al Shafaay ◽

F. El Haj Hassan ◽

M. Korek

Keyword(s):

Ternary Alloys ◽

First Principle ◽

Mercury Chalcogenides

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First principle investigation of structural, electronic and optical properties of Mg Zn1−S hexagonal wurtzite ternary alloys

Materials Today Proceedings ◽

10.1016/j.matpr.2020.04.523 ◽

2020 ◽

Author(s):

Utpal Sarkar ◽

Surya Chattopadhyaya

Keyword(s):

Optical Properties ◽

Ternary Alloys ◽

First Principle ◽

Electronic And Optical Properties

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FIRST PRINCIPLE ELECTRONIC, MAGNETIC, AND THERMODYNAMIC CHARACTERIZATION OF Gd Cu X 2 (X= Cd, IN, Mg) ISOSTRUCTURAL TERNARY ALLOYS

i-manager s Journal on Material Science ◽

10.26634/jms.7.2.15646 ◽

2019 ◽

Vol 7 (2) ◽

pp. 18

Author(s):

KUMAR NAVEEN ◽

KUMAR SACHIN ◽

YADAV KAMNA ◽

SAGAR JYOTI ◽

PAL SINGH RISHI ◽

...

Keyword(s):

Ternary Alloys ◽

First Principle ◽

Thermodynamic Characterization

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Systematic, First Principle Study of Ambient Temperature Ferromagnetism and Elastic Anisotropy of Cubic Ca0.75TM0.25S (TM = Mn, Co, and Ni) Ternary Alloys: Using mBJ Functional

Journal of Superconductivity and Novel Magnetism ◽

10.1007/s10948-020-05706-9 ◽

2020 ◽

Author(s):

Ouafa Hamidane ◽

Athmane Meddour ◽

Mohammed Hadi Gous ◽

Chahrazed Bourouis

Keyword(s):

Ambient Temperature ◽

Elastic Anisotropy ◽

Ternary Alloys ◽

First Principle

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First-principle calculation of APB energy in Ni-based binary and ternary alloys

Modelling and Simulation in Materials Science and Engineering ◽

10.1088/0965-0393/19/2/025008 ◽

2011 ◽

Vol 19 (2) ◽

pp. 025008 ◽

Author(s):

Mahesh Chandran ◽

S K Sondhi

Keyword(s):

Ternary Alloys ◽

First Principle ◽

Principle Calculation ◽

First Principle Calculation

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First principle electronic structure calculations of ternary alloys Hg1−xMnxTe in zinc-blende structure

Journal of Magnetism and Magnetic Materials ◽

10.1016/j.jmmm.2012.04.048 ◽

2012 ◽

Vol 324 (19) ◽

pp. 3017-3023 ◽

Author(s):

U.P. Verma ◽

Sonu Sharma ◽

Nisha Devi ◽

P. Rajaram

Keyword(s):

Electronic Structure ◽

Electronic Structure Calculations ◽

Ternary Alloys ◽

First Principle ◽

Zinc Blende ◽

Structure Calculations ◽

Zinc Blende Structure

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First principle study of the structural, electronic, optical and thermodynamic properties of the cubic Al1−xBxAs ternary alloys

Materials Research Express ◽

10.1088/2053-1591/ab3555 ◽

2019 ◽

Vol 6 (10) ◽

pp. 105902

Author(s):

Rabah Moussa ◽

Ahmed Abdiche ◽

Rabah Khenata ◽

Saad Bin Omran

Keyword(s):

Thermodynamic Properties ◽

Ternary Alloys ◽

First Principle

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First principle characterization of structural, electronic, mechanical, thermodynamic, linear and nonlinear optical properties of zinc blende InAs, InSb and their InAsxSb1-x ternary alloys

Journal of Physics and Chemistry of Solids ◽

10.1016/j.jpcs.2019.04.031 ◽

2019 ◽

Vol 132 ◽

pp. 213-221 ◽

Author(s):

Y. Asadi ◽

Z. Nourbakhsh

Keyword(s):

Optical Properties ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Ternary Alloys ◽

First Principle ◽

Zinc Blende ◽

Linear And Nonlinear

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First-principle calculations of the structural, electronic, thermodynamic and thermal properties of ZnS x Se1−x ternary alloys

Bulletin of Materials Science ◽

10.1007/s12034-015-0877-0 ◽

2015 ◽

Vol 38 (2) ◽

pp. 365-372 ◽

Author(s):

S BENDAIF ◽

A BOUMAZA ◽

O NEMIRI ◽

K BOUBENDIRA ◽

H MERADJI ◽

...

Keyword(s):

Thermal Properties ◽

Ternary Alloys ◽

First Principle ◽

First Principle Calculations

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Beryllium (Be) composition dependent structural and optoelectronic characteristics of wurtzite Be Mg1-S ternary alloys: First principle calculations with FP-LAPW scheme

Materials Chemistry and Physics ◽

10.1016/j.matchemphys.2020.123946 ◽

2021 ◽

Vol 258 ◽

pp. 123946

Author(s):

Bimal Debnath ◽

Debankita Ghosh ◽

Manish Debbarma ◽

Sayantika Chanda ◽

Subhendu Das ◽

...

Keyword(s):

Ternary Alloys ◽

First Principle ◽

First Principle Calculations

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First principle investigations of structural, electronic and magnetic properties of Cr doped zinc-blende MgTe ternary alloys with DFT based FP-LAPW approach

Materials Today Proceedings ◽

10.1016/j.matpr.2020.05.491 ◽

2020 ◽

Author(s):

Subhendu Das ◽

Surya Chattopadhyaya ◽

Rahul Bhattacharjee

Keyword(s):

Magnetic Properties ◽

Ternary Alloys ◽

First Principle ◽

Electronic And Magnetic Properties ◽

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