100 citations · 343 across the 9 of their papers we have counts for
9 papers
Half-metallic ferromagnetism in SrRuO
Pablo Rivero, Vincent Meunier, William Shelton
The bilayered member of the Ruddesden-Popper family of ruthenates, SrRuO, has received an increasing attention due to its interesting properties and phases. By using fi…
Revisiting the zero-temperature phase diagram of stoichiometric SrCoO3 with first-principles methods
Pablo Rivero, Claudio Cazorla
By using first-principles methods based on density functional theory we revisited the zero-temperature phase diagram of stoichiometric SrCoO3, a ferromagnetic metallic perovskite t…
Uniaxial pressure induced half-metallic ferromagnetic phase transition in LaMnO
Pablo Rivero, Vincent Meunier, William Shelton
We use first-principles theory to predict that the application of uniaxial compressive strain leads to a transition from an antiferromagnetic insulator to a ferromagnetic half-meta…
Electronic, structural, and magnetic properties of LaMnO phase transition at high temperature
Pablo Rivero, Vincent Meunier, William Shelton
We develop a procedure to determine the portion of exact Hartree-Fock exchange interaction contained in a hybrid density functional to treat the range of electronic correlation gov…
Intrinsic defects, fluctuations of the local shape, and the photo-oxidation of black phosphorus
Kainen L. Utt, Pablo Rivero, Mehrshad Mehboudi +4
Black phosphorus is a monoatomic semiconducting layered material that degrades exothermically in the presence of light and ambient contaminants. Its degradation dynamics remain lar…
Anomalous charge and negative-charge-transfer insulating state in cuprate chain-compound KCuO_2
D. Choudhury, P. Rivero, D. Meyers +8
Using a combination of X-ray absorption spectroscopy experiments with first principle calculations, we demonstrate that insulating KCuO_2 contains Cu in an unusually-high formal-3+…
Simulated scanning tunneling microscopy images of few-layer-phosphorus capped by graphene and hexagonal boron nitride monolayers
Pablo Rivero, Cedric M. Horvath, Zhen Zhu +3
Elemental phosphorous is believed to have several stable allotropes that are energetically nearly degenerate, but chemically reactive. To prevent chemical degradation under ambient…
Stability and properties of high-buckled two-dimensional tin and lead
Pablo Rivero, Jia-An Yan, Victor M. Garcia-Suarez +2
In realizing practical non-trivial topological electronic phases stable structures need to be determined first. Tin and lead do stabilize an optimal two-dimensional high-buckled ph…
Polar catastrophe in ultra-thin limit: A case of rare-earth perovskite LaNiO3
S. Middey, P. Rivero, D. Meyers +6
We address the fundamental issue of growth of perovskite ultra-thin films under the condition of a strong polar mismatch at the heterointerface exemplified by the growth of a corre…