Thermodynamic Properties of Elements and Compounds in Al-Sc Binary System from Ab Initio Calculations Based on Density Functional Theory

Prediction of the site ordering behaviours of elements in C15 NbCr2-based intermetallics by combining thermodynamic model with ab-initio calculation

(2013) Bo Wu et al.   INTERMETALLICS

Thermodynamic Properties of MgSc and AlSc from First-Principles Phonon Calculations

(2012) Rui Wang et al.   INTERNATIONAL JOURNAL OF THERMOPHYSICS

First-Principles Calculations on Structure, Elastic and Thermodynamic Properties of Al2X (X=Sc, Y) under Pressure

(2012) Yasemin Öztekin Çiftci et al.   JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY

Ab initio investigation of structural, electronic, mechanical, and thermodynamic properties of AlSc2 intermetallic compound under pressure

(2011) Mingjun Pang et al.   JOURNAL OF APPLIED PHYSICS

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

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

Phonon and elastic properties of AlSc and MgSc from first-principles calculations

(2010) Şule Ugˇur et al.   COMPUTATIONAL MATERIALS SCIENCE

First-Principles Calculations and CALPHAD Modeling of Thermodynamics

(2009) Zi-Kui Liu   JOURNAL OF PHASE EQUILIBRIA AND DIFFUSION

Ab initiostudy on the thermal properties of the fcc Al3Mg and Al3Sc alloys

(2009) Dong-Lin Li et al.   JOURNAL OF PHYSICS D-APPLIED PHYSICS

Elastic Properties, Thermal Expansion Coefficients, and Electronic Structures of Mg and Mg-Based Alloys

(2009) Kuiying Chen et al.   METALLURGICAL AND MATERIALS TRANSACTIONS A-PHYSICAL METALLURGY AND MATERIALS SCIENCE

Calculations of thermodynamic properties of PuO2 by the first-principles and lattice vibration

(2008) Satoshi Minamoto et al.   JOURNAL OF NUCLEAR MATERIALS

First-Principles Calculation of Phase Stability and Cohesive Properties of Ni-Sn Intermetallics

(2008) G. Ghosh   METALLURGICAL AND MATERIALS TRANSACTIONS A-PHYSICAL METALLURGY AND MATERIALS SCIENCE

Phonons in aluminum at high temperatures studied by inelastic neutron scattering

(2008) M. Kresch et al.   PHYSICAL REVIEW B

Prediction of the ordering behaviours of the orthorhombic phase based on Ti2AlNb alloys by combining thermodynamic model with ab initio calculation

(2007) Bo Wu et al.   INTERMETALLICS