Lattice dynamics, mechanical stability and electronic structure of Fe-based Heusler semiconductors

Magneto-electronic and thermoelectric properties of some Fe-based Heusler alloys

(2018) Idris Hamid Bhat et al.   JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS

First principles understanding of structural electronic and magnetic properties of new quaternary Heusler alloy: FeVRuSi

(2018) Shakeel Ahmad Khandy   Materials Research Express

Predicting the electronic structure, magnetism, and transport properties of new Co-based Heusler alloys

(2018) Shakeel Ahmad Khandy et al.   INTERNATIONAL JOURNAL OF ENERGY RESEARCH

Structural, elastic and magneto-electronic properties of half-metallic BaNpO 3 perovskite

(2017) Shakeel Ahmad Khandy et al.   MATERIALS CHEMISTRY AND PHYSICS

MoS2-graphene in-plane contact for high interfacial thermal conduction

(2017) Xiangjun Liu et al.   Nano Research

DFT investigations on mechanical stability, electronic structure and magnetism in Co2TaZ (Z = Al, Ga, In) heusler alloys

(2017) Shakeel Ahmad Khandy et al.   SEMICONDUCTOR SCIENCE AND TECHNOLOGY

Anti-site-induced diverse diluted magnetism in LiMgPdSb-type CoMnTiSi alloy

(2017) T. T. Lin et al.   Scientific Reports

The Critical Role of Substrate in Stabilizing Phosphorene Nanoflake: A Theoretical Exploration

(2016) Junfeng Gao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Static and Dynamical Properties of heavy actinide Monopnictides of Lutetium

(2016) Showkat H. Mir et al.   Scientific Reports

Giant Phononic Anisotropy and Unusual Anharmonicity of Phosphorene: Interlayer Coupling and Strain Engineering

(2015) Yongqing Cai et al.   ADVANCED FUNCTIONAL MATERIALS

Low-Dimensional Transport and Large Thermoelectric Power Factors in Bulk Semiconductors by Band Engineering of Highly Directional Electronic States

(2015) Daniel I. Bilc et al.   PHYSICAL REVIEW LETTERS

Electronic structure, magnetism and phase stability of isostructural Ga2MnCo–Ga2MnV Heusler alloys from first principles

(2014) Jiahua Chen et al.   COMPUTATIONAL MATERIALS SCIENCE

Structural, electronic, optical and thermodynamic properties of cubic REGa3 (RE=Sc or Lu) compounds: Ab initio study

(2014) G. Murtaza et al.   JOURNAL OF ALLOYS AND COMPOUNDS

Magneto-transport and microstructure of Co2Fe(Ga0.5Ge0.5)/Cu lateral spin valves prepared by top-down microfabrication process

(2014) Ikhtiar et al.   JOURNAL OF APPLIED PHYSICS

Lattice vibrational modes and phonon thermal conductivity of monolayer MoS2

(2014) Yongqing Cai et al.   PHYSICAL REVIEW B

Necessary and sufficient elastic stability conditions in various crystal systems

(2014) Félix Mouhat et al.   PHYSICAL REVIEW B

Large recovery strain in Fe-Mn-Si-based shape memory steels obtained by engineering annealing twin boundaries

(2014) Y.H. Wen et al.   Nature Communications

Spin Injection, Transport, and Detection at Room Temperature in a Lateral Spin Transport Device with Co2FeAl0.5Si0.5/n-GaAs Schottky Tunnel Junctions

(2013) Tatsuya Saito et al.   Applied Physics Express

Slater-Pauling behavior in LiMgPdSn-type multifunctional quaternary Heusler materials: Half-metallicity, spin-gapless and magnetic semiconductors

(2013) K. Özdoğan et al.   JOURNAL OF APPLIED PHYSICS

Ab initiocalculation of the effective on-site Coulomb interaction parameters for half-metallic magnets

(2013) Ersoy Şaşıoğlu et al.   PHYSICAL REVIEW B

Realization of Spin Gapless Semiconductors: The Heusler CompoundMn2CoAl

(2013) Siham Ouardi et al.   PHYSICAL REVIEW LETTERS

Design Scheme of New Tetragonal Heusler Compounds for Spin-Transfer Torque Applications and its Experimental Realization

(2012) Jürgen Winterlik et al.   ADVANCED MATERIALS

Effect of interfacial strain on spin injection and spin polarization of Co2CrAl/NaNbO3/Co2CrAl magnetic tunneling junction

(2012) Yongqing Cai et al.   EPL

Stable magnetostructural coupling with tunable magnetoresponsive effects in hexagonal ferromagnets

(2012) Enke Liu et al.   Nature Communications

Modeling hardness of polycrystalline materials and bulk metallic glasses

(2011) Xing-Qiu Chen et al.   INTERMETALLICS

Effect of onsite Coulomb repulsion on thermoelectric properties of full-Heusler compounds with pseudogaps

(2011) Dat Do et al.   PHYSICAL REVIEW B

Half-metallicity and Gilbert damping constant in Co2FexMn1−xSi Heusler alloys depending on the film composition

(2009) Takahide Kubota et al.   APPLIED PHYSICS LETTERS

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

(2009) Paolo Giannozzi et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Superconductivity in palladium-based Heusler compounds

(2009) Jürgen Winterlik et al.   PHYSICAL REVIEW B

Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential

(2009) Fabien Tran et al.   PHYSICAL REVIEW LETTERS