We conducted a joint experimental-theoretical investigation of the high-pressure chemistry of europium polyhydrides at pressures of 86-130 GPa. We discovered several novel magnetic Eu superhydrides stabilized by anharmonic effects: cubic EuH9, hexagonal EuH9, and an unexpected cubic (Pm-3n) clathrate phase, Eu8H46. Monte Carlo simulations indicate that cubic EuH9 has antiferromagnetic ordering with T(Neel) up to 24 K, whereas hexagonal EuH9 and Pm-3n-Eu8H46 possess ferromagnetic ordering with T(Curie) = 137 and 336 K, respectively. The electron-phonon interaction is weak in all studied europium hydrides, and their magnetic ordering excludes s-wave superconductivity, except, perhaps, for distorted pseudohexagonal EuH9. The equations of state predicted within the DFT+U approach (the Hubbard corrections were found within linear response theory) are in close agreement with the experimental data. This work shows the great influence of the atomic radius on symmetry-breaking distortions of the crystal structures of superhydrides and on their thermodynamic stability.
@article{arxiv.2012.05595,
title = {Novel Strongly Correlated Europium Superhydrides},
author = {Dmitrii V. Semenok and Di Zhou and Alexander G. Kvashnin and Xiaoli Huang and Michele Galasso and Ivan A. Kruglov and Anna G. Ivanova and Alexander G. Gavrilyuk and Wuhao Chen and Nikolay V. Tkachenko and Alexander I. Boldyrev and Ivan Troyan and Artem R. Oganov and Tian Cui},
journal= {arXiv preprint arXiv:2012.05595},
year = {2020}
}