Theoretical predictions of the structural, mechanical and lattice dynamical properties of XW2(X = Zr, Hf) Laves phases

First-principles study of structural and electronic properties of C14-type Laves phase Al2Zr and Al2Hf

(2013) Wen-Cheng Hu et al.   COMPUTATIONAL MATERIALS SCIENCE

Theoretical studies of elastic properties of orthorhombic LiBH4

(2013) Shina Li et al.   COMPUTATIONAL MATERIALS SCIENCE

First-principles study on the structure, elastic properties, hardness and electronic structure of TMB4 (TM=Cr, Re, Ru and Os) compounds

(2013) Y. Pan et al.   JOURNAL OF SOLID STATE CHEMISTRY

The first principles investigation of lattice dynamical and thermodynamical properties of Al2Ca and Al2Mg compounds in the cubic Laves structure

(2012) E. Deligoz et al.   COMPUTATIONAL MATERIALS SCIENCE

Ab initio investigations of phonons and superconductivity in the cubic Laves structures LaAl2 and YAl2

(2012) S. Duman et al.   JOURNAL OF APPLIED PHYSICS

Structure and hydrogen storage properties of the hexagonal Laves phase Sc(Al1−xNix)2

(2012) Martin Sahlberg et al.   JOURNAL OF SOLID STATE CHEMISTRY

Modeling hardness of polycrystalline materials and bulk metallic glasses

(2011) Xing-Qiu Chen et al.   INTERMETALLICS

Structural, elastic, and thermal properties of Laves phase ZrV2 under pressure

(2011) Xinyu Zhang et al.   JOURNAL OF APPLIED PHYSICS

High hardness, low Young's modulus and low friction of nanocrystalline ZrW2 Laves phase and Zr1−xWx thin films

(2011) D. Horwat et al.   JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS

Structural, electronic, magnetic and elastic properties of tetragonal layered diselenide KCo2Se2 from first principles calculations

(2011) V.V. Bannikov et al.   PHYSICA B-CONDENSED MATTER

Lattice vibrational properties of Al2X  (X  =   Sc, Y) from density functional theory calculations

(2011) E. Deligoz et al.   SOLID STATE COMMUNICATIONS

Mechanical and phonon properties of the superhard LuB2, LuB4, and LuB12 compounds

(2010) E. Deligoz et al.   JOURNAL OF ALLOYS AND COMPOUNDS

Electronic and structural properties of Laves-phaseMgZn2of varying chemical disorder

(2010) M. Andersson et al.   PHYSICAL REVIEW B

Lattice dynamic properties of BaSi2 and BaGe2 from first principle calculations

(2010) H. Peng et al.   PHYSICS LETTERS A

First-principles investigation of the binary AB2 type Laves phase in Mg–Al–Ca alloy: Electronic structure and elastic properties

(2009) Wei-Yang Yu et al.   SOLID STATE SCIENCES

Properties of nanocrystalline and nanocomposite WxZr1−x thin films deposited by co-sputtering

(2008) D. Horwat et al.   INTERMETALLICS