Elastic anisotropy and electronic properties of Si3N4 under pressures

Analytic Equation of State and Thermodynamic Properties for α-, β-, and γ-Si3N4Based on Analytic Mean Field Approach

(2016) L.G. Wang et al.   ACTA PHYSICA POLONICA A

Prediction of novel hard phases of Si 3 N 4 : First-principles calculations

(2015) Lin Cui et al.   JOURNAL OF SOLID STATE CHEMISTRY

Elastic and electronic properties of Pbca-BN: First-principles calculations

(2014) Qingyang Fan et al.   COMPUTATIONAL MATERIALS SCIENCE

Anisotropic elastic properties of the Ca–Pb compounds

(2014) Y.H. Duan et al.   JOURNAL OF ALLOYS AND COMPOUNDS

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

Predictions of pressure-induced structural transition, mechanical and thermodynamic properties of α- and β-Si3N4ceramics:ab initioand quasi-harmonic Debye modeling

(2012) Ben-Hai Yu et al.   Chinese Physics B

Exotic Cubic Carbon Allotropes

(2012) Meng Hu et al.   Journal of Physical Chemistry C

Novel High-Pressure Phase of RhB: First-Principles Calculations

(2011) Qianqian Wang et al.   Journal of Physical Chemistry C

Equilibrium and metastable phase transitions in silicon nitride at high pressure: A first-principles and experimental study

(2011) Bin Xu et al.   PHYSICAL REVIEW B

Crystal structure prediction via particle-swarm optimization

(2010) Yanchao Wang et al.   PHYSICAL REVIEW B

First-principles lattice dynamics calculations of the phase boundary between β-Si3N4and γ-Si3N4at elevated temperatures and pressures

(2008) Atsushi Togo et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Lattice dynamics and thermodynamical properties of silicon nitride polymorphs

(2008) Akihide Kuwabara et al.   PHYSICAL REVIEW B

Universal Elastic Anisotropy Index

(2008) Shivakumar I. Ranganathan et al.   PHYSICAL REVIEW LETTERS