30 citations · 36 across the 12 of their papers we have counts for
5 papers · 1 filter
Quantum Anharmonic Effects on the Superconductivity of I-43m CH4-H3S at High Pressures: a First-Principles Study
Pugeng Hou, Francesco Belli, Tiange Bi +2
Making use of first-principles calculations we analyze the effect of quantum ionic fluctuations and lattice anharmonicity on the crystal structure and superconductivity of I-43m CH…
Efficient Modelling of Anharmonicity and Quantum Effects in PdCuH with Machine Learning Potentials
Francesco Belli, Eva Zurek
Quantum nuclear effects and anharmonicity impact a wide range of functional materials and their properties. One of the most powerful techniques to model these effects is the Stocha…
Superconductivity in Dilute Hydrides of Ammonia under Pressure
Xiaoyu Wang, Nisha Geng, Kyla de Villa +2
In the last decade, there has been great progress in predicting and synthesizing polyhydrides that exhibit superconductivity when squeezed. Dopants allow these compounds to become…
Quantum Stabilization and Flat Hydrogen-based Bands of Nitrogen-doped Lutetium Hydride
Adam Denchfield, Francesco Belli, Eva Zurek +2
We explore electronic and structural properties of Fmm Lu-H-N structures with specific N,H ordering as plausible candidates for near-ambient superconductivity possibl…
Phase Boundaries, Isotope Effect and Superconductivity of Lithium Under Hydrostatic Conditions
Stefano Racioppi, Iren Saffarian-Deemyad, William Holle +6
We present theoretical and experimental studies of superconductivity and low temperature structural phase boundaries in lithium. We mapped the structural phase diagram of 6Li and 7…