161 citations · 1k across the 54 of their papers we have counts for
6 papers · 2 filters
Giant Direct and Inverse Electrocaloric Effects in Multiferroic Thin Films
Claudio Cazorla, Jorge Iniguez
Refrigeration systems based on compression of greenhouse gases are environmentally threatening and cannot be scaled down to on-chip dimensions. In the vicinity of a phase transitio…
Comment on "High-pressure phases of group-II difluorides: Polymorphism and superionicity"
Claudio Cazorla, Daniel Errandonea
Nelson et al. [Phys. Rev. B 95, 054118 (2017)] recently have reported first-principles calculations on the behaviour of group-II difluorides (BeF, MgF, and CaF) u…
First-principles prediction of half-Heusler half-metals above room temperature
Muhammad Atif Sattar, S. Aftab Ahmad, Fayyaz Hussain +1
Half-metallicity (HM) offers great potential for engineering spintronic applications, yet only few magnetic materials present metallicity in just one spin channel. In addition, mos…
Polymorphism of Bulk Boron Nitride
Claudio Cazorla, Tim Gould
Boron nitride (BN) is a material with outstanding technological promise because of its exceptional thermochemical stability, structural, electronic and thermal conductivity propert…
Mixing thermodynamics and photocatalytic properties of GaP-ZnS solid solutions
Joel Shenoy, Judy N. Hart, Ricardo Grau-Crespo +2
Preparation of solid solutions represents an effective means to improve the photocatalytic properties of semiconductor-based materials. Nevertheless, the effects of site-occupancy…
Influence of lattice dynamics on lithium-ion conductivity: A first-principles study
Arun K. Sagotra, Dewei Chu, Claudio Cazorla
In the context of novel solid electrolytes for solid-state batteries, first-principles calculations are becoming increasingly more popular due to their ability to reproduce and pre…