Eliminating Artificial Boundary Conditions in Time-Dependent Density Functional Theory Using Fourier Contour Deformation

Kaye, J.
Barnett, A.
Greengard, L.
De Giovannini, U.
Rubio, A.

Journal:

Journal of Chemical Theory and Computation

ISSN: 1549-9626, 1549-9618

Year of publication: 2023

Volume: 19

Issue: 5

Pages: 1409-1420

Type: Article

DOI: 10.1021/ACS.JCTC.2C01013 GOOGLE SCHOLAR

Data source: Scopus