7.7k citations · 7.9k across the 5 of their papers we have counts for
5 papers
Advanced capabilities for materials modelling with Quantum ESPRESSO
P. Giannozzi, O. Andreussi, T. Brumme +47
Quantum ESPRESSO is an integrated suite of open-source computer codes for quantum simulations of materials using state-of-the art electronic-structure techniques, based on density-…
Emergence of ferromagnetism and Jahn-Teller distortion in low Cr-substituted LaMnO3
A. Y. Ramos, H. C. N. Tolentino, O. Bunau +9
The emergence of a ferromagnetic component in with low Cr-for-Mn substitution has been studied by x-ray absorption spectroscopy and x-ray magnetic circular dichroism at…
Projector augmented wave calculation of x-ray absorption spectra at the L2,3 edges
Oana Bunau, Matteo Calandra
We develop a technique based on density functional theory and the projector augmented wave method in order to obtain the x-ray absorption cross section at a general edge, both in t…
Stability of the Ni sites across the pressure-induced metallization in YNiO3
A. Y. Ramos, C. Piamonteze, H. C. N. Tolentino +7
The local environment of nickel atoms in Y NiO3 across the pressure- induced insulator to metal (IM) transition was studied using X-ray absorption spectroscopy (XAS) supported by a…
Ground State of the Quasi-1D \bvs\ resolved by Resonant Magnetic X-ray Scattering
Ph. Leininger, V. Ilakovac, Y. Joly +6
Resonant-magnetic x-ray scattering (RMXS) near the vanadium -absorption edges has been used to investigate the low temperature magnetic structure of high quality \bvs\ sin…