Institute of High Performance Computing

output

20052009

most citedFirst-principles calculation of the thermodynamics of In

_{x}

_{1 - x}

N alloys: Effect of lattice vibrations

90 citations

Showing cond-mat.mtrl-sciShow all

3 papers · 1 filter

cond-mat.mtrl-sci2007★ 11 cited

Phase field simulations of coupled phase transformations in ferroelastic-ferroelastic nanocomposites

Mathieu Bouville, Rajeev Ahluwalia

We use phase field simulations to study composites made of two different ferroelastics (e.g., two types of martensite). The deformation of one material due to a phase transformatio…

cond-mat.mtrl-sci2006★ 47 cited

First-principles study of wurtzite InN $(0001)$ and $(000 1 ˉ)$ surfaces

Chee Kwan Gan, David J. Srolovitz

Density-functional calculations are used to study various plausible structures of the wurtzite InN $(0001)$ and $(000 1 ˉ)$ surfaces. These structures include the unreconstruct…

cond-mat.mtrl-sci2006★ 90 cited

First-principles calculation of the thermodynamics of In $_{x}$ Ga $_{1 - x}$ N alloys: Effect of lattice vibrations

Chee Kwan Gan, Yuan Ping Feng, David J. Srolovitz

The thermodynamics properties of the wurtzite and zinc-blende \InGaN alloys are calculated using first-principles density-functional calculations. Special quasi-random structures a…

Phase field simulations of coupled phase transformations in ferroelastic-ferroelastic nanocomposites

First-principles study of wurtzite InN(0001) and (0001ˉ) surfaces

First-principles calculation of the thermodynamics of Inx​Ga1−x​N alloys: Effect of lattice vibrations

First-principles study of wurtzite InN $(0001)$ and $(000 1 ˉ)$ surfaces

First-principles calculation of the thermodynamics of In $_{x}$ Ga $_{1 - x}$ N alloys: Effect of lattice vibrations