496 citations · 1.1k across the 9 of their papers we have counts for
Showing 2018Show all
2 papers · 1 filter
cond-mat.mtrl-sci2018★ 3 cited
Reply to "Comment on 'High-pressure phases of group-II difluorides: Polymorphism and superionicity' "
Joseph R. Nelson, Richard J. Needs, Chris J. Pickard
Cazorla et al. [preceding comment] criticize our recent results on the high-PT phase diagram of CaF2 (Phys. Rev. B 95, 054118 (2017)). According to our analysis, Cazorla et al. hav…
cond-mat.mtrl-sci2018★ 9 cited
High-pressure CaF2 revisited: a new high-temperature phase and the role of phonons in the search for superionic conductivity
Joseph R. Nelson, Richard J. Needs, C. J. Pickard
We recently proposed a high-pressure and high-temperature P-62m-symmetry polymorph for CaF2 on the basis of ab-initio random structure searching and density-functional theory calcu…