works on

From the 1 of 21 linked papers with an AI index.

activity
20032023
most citedQuantum ESPRESSO: a modular and open-source software project for quantum simulations of materials

29.3k citations · 33.1k across the 21 of their papers we have counts for

collaborators

21 papers

cond-mat.mtrl-sci2023★ 7 cited

Electron-phonon physics from first principles using the EPW code

Hyungjun Lee, Samuel Poncé, Kyle Bushick +13

EPW is an open-source software for calculations of electron-phonon interactions and related materials properties. The code combines density functional perturba…

cond-mat.supr-con2022

Exploring the Effect of the Number of Hydrogen Atoms on the Properties of Lanthanide Hydrides by DMFT

Yao Wei, Elena Chachkarova, Evgeny Plekhanov +2

Lanthanide hydrogen-rich materials have long been considered as one of the candidates with high-temperature superconducting properties in condensed matter physics, and have attract…

cond-mat.supr-con2022

High temperature superconductivity in the lanthanide hydrides at extreme pressures

Yao Wei, Francesco Macheda, Zelong Zhao +4

Hydrogen-rich superhydrides are promising high-Tc superconductors, with superconductivity experimentally observed near room temperature, as shown in recently discovered lanthanide…

cond-mat.mes-hall2021

Theory and computation of Hall scattering factor in graphene

Francesco Macheda, Samuel Poncé, Feliciano Giustino +1

The Hall scattering factor, , is a key quantity for establishing carrier concentration and drift mobility from Hall measurements; in experiments it is usually assumed to be 1. I…

cond-mat.supr-con2021

Computational Materials Discovery for Lanthanide Hydrides at high pressure: predicting High Temperature superconductivity

Evgeny Plekhanov, Zelong Zhao, Francesco Macheda +3

Hydrogen-rich superhydrides are believed to be very promising high-T superconductors, with experimentally observed critical temperatures near room temperature, as shown in rece…

cond-mat.mtrl-sci2021★ 127 cited

First-principles predictions of Hall and drift mobilities in semiconductors

Samuel Ponce, Francesco Macheda, Elena Roxana Margine +3

Significant progress on parameter-free calculations of carrier mobilities in real materials has been made during the past decade; however, the role of various approximations remain…