turboEELS—A code for the simulation of the electron energy loss and inelastic X-ray scattering spectra using the Liouville–Lanczos approach to time-dependent density-functional perturbation theory

Published 2015 View Full Article

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Title
turboEELS—A code for the simulation of the electron energy loss and inelastic X-ray scattering spectra using the Liouville–Lanczos approach to time-dependent density-functional perturbation theory
Authors
Keywords
Electron energy loss spectroscopy, Inelastic X-ray scattering, Time-dependent density functional perturbation theory, Quantum ESPRESSO, Linear response, Liouville–Lanczos approach
Journal
COMPUTER PHYSICS COMMUNICATIONS
Volume 196, Issue -, Pages 460-469
Publisher
Elsevier BV
Online
2015-06-06
DOI
10.1016/j.cpc.2015.05.021

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