First-principles calculation of magnetic, structural, dynamic, electronic, elastic, thermodynamic and thermoelectric properties of Co2ZrZ (Z = Al, Si) Heusler alloys

High Pressure-Temperature study on thermodynamics, half-metallicity, transport, elastic and structural properties of Co-based Heusler alloys: A first-principles study

(2020) Shakeel Ahmad Sofi et al.   JOURNAL OF SOLID STATE CHEMISTRY

Systematic understanding of half-metallicity of ternary compounds in Heusler and Inverse Heusler structures with 3d and 4d elements

(2019) Srikrishna Ghosh et al.   PHYSICA SCRIPTA

Electronic and Magnetic Structure and Elastic and Thermal Properties of Mn2-Based Full Heusler Alloys

(2019) Inshad Jum’h et al.   Journal of Superconductivity and Novel Magnetism

Magnetocaloric properties and critical behavior of Co2Cr1−xMnxAl Heusler alloys

(2019) Priyanka Nehla et al.   JOURNAL OF APPLIED PHYSICS

Promising spintronics: Mn-based Heusler alloys Mn3Ga, Mn2YGa (Y = V, Nb, Ta), ScMnVGa

(2019) Li Fan et al.   JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS

Structural, magnetic, electronic and mechanical properties of full-Heusler alloys Co 2 YAl (Y = Fe, Ti): First principles calculations with different exchange-correlation potentials

(2018) Belkharroubi Fadila et al.   JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS

Band Structures and Transport Properties of High-Performance Half-Heusler Thermoelectric Materials by First Principles

(2018) Teng Fang et al.   Materials

Half-Metallic Ferrimagnetic Characteristics of Co2YZ (Z = P, As, Sb, and Bi) New Full-Heusler Alloys: a DFT Study

(2017) O. Amrich et al.   Journal of Superconductivity and Novel Magnetism

First-Principle Investigation of Structural, Electronic and Magnetic Properties in Mn2RhZ (Z = Si, Ge, and Sn) Heusler Alloys

(2016) Djillali Bensaid et al.   Journal of Superconductivity and Novel Magnetism

First principles study of a new half-metallic ferrimagnets Mn2-based full Heusler compounds: Mn2ZrSi and Mn2ZrGe

(2015) A. Abada et al.   JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS

First principles phonon calculations in materials science

(2015) Atsushi Togo et al.   SCRIPTA MATERIALIA

Dissolution of Thermoelectric Materials Containing Te with Acidic Solutions

(2015) Hwa Young Lee et al.   SEPARATION SCIENCE AND TECHNOLOGY

Connecting Thermoelectric Performance and Topological-Insulator Behavior:Bi2Te3andBi2Te2Sefrom First Principles

(2015) Hongliang Shi et al.   Physical Review Applied

Thermoelectric properties of topological insulator Bi2Te3, Sb2Te3, and Bi2Se3 thin film quantum wells

(2014) Hermann Osterhage et al.   APPLIED PHYSICS LETTERS

Elastic constants of cubic crystals

(2014) M. Jamal et al.   COMPUTATIONAL MATERIALS SCIENCE

Gibbs2: A new version of the quasiharmonic model code. II. Models for solid-state thermodynamics, features and implementation

(2011) A. Otero-de-la-Roza et al.   COMPUTER PHYSICS COMMUNICATIONS

Gibbs2: A new version of the quasi-harmonic model code. I. Robust treatment of the static data

(2011) A. Otero-de-la-Roza et al.   COMPUTER PHYSICS COMMUNICATIONS

Epitaxial growth and thermoelectric properties of TiNiSn and Zr0.5Hf0.5NiSn thin films

(2011) Tino Jaeger et al.   THIN SOLID FILMS

Cooling, Heating, Generating Power, and Recovering Waste Heat with Thermoelectric Systems

(2008) Lon E. Bell   SCIENCE