42 citations · 60 across the 2 of their papers we have counts for
2 papers
cond-mat.mtrl-sci2013★ 18 cited
Ab initio calculation of anisotropic interfacial excess free energies
Axel van de Walle, Chirranjeevi Balaji Gopal, Steve Demers +5
We describe a simple method to determine, from ab initio calculations, the complete orientation-dependence of interfacial free energies in solid-state crystalline systems. We illus…
cond-mat.mtrl-sci2010★ 42 cited
Entropic Stabilization and Retrograde Solubility in Zn4Sb3
Gregory S. Pomrehn, Eric S. Toberer, G. Jeffrey Snyder +1
Zn4Sb3 is shown to be entropically stabilized versus decomposition to Zn and ZnSb though the effects of configurational disorder and phonon free energy. Single phase stability is p…