Lattice dynamics calculations based on density-functional perturbation theory in real space

Author: Honghui Shang; Christian Carbogno; Patrick Rinke; Matthias Scheffler

View Paper

@article{Shang2017_CPC,
 author = {Shang, Honghui and Carbogno, Christian and Rinke, Patrick and Scheffler, Matthias},
 doi = {10.1016/j.cpc.2017.02.001},
 file = {:C$\backslash$:/Users/shanghui/AppData/Local/Mendeley Ltd./Mendeley Desktop/Downloaded/Shang et al. - 2017 - Lattice dynamics calculations based on density-functional perturbation theory in real space.pdf:pdf},
 issn = {00104655},
 journal = {Computer Physics Communications},
 keywords = {Atom-centered basis functions,Density-function theory,Density-functional perturbation theory,Lattice dynamics},
 month = {jun},
 pages = {26--46},
 title = {Lattice dynamics calculations based on density-functional perturbation theory in real space},
 url = {http://www.sciencedirect.com/science/article/pii/S0010465517300437 https://linkinghub.elsevier.com/retrieve/pii/S0010465517300437},
 volume = {215},
 year = {2017}
}