An efficient algorithm for time propagation as applied to linearized augmented plane wave method

DOI10.1016/j.cpc.2016.09.001zbMath1375.81256WikidataQ57604449 ScholiaQ57604449MaRDI QIDQ1682948

Peng Zhang

Publication date: 6 December 2017

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/j.cpc.2016.09.001

zbMATH Keywords

time-dependent density functional theory; linearized augmented plane waves; spin-dynamics; time propagation algorithm

Mathematics Subject Classification ID

35Q40: PDEs in connection with quantum mechanics

81V70: Many-body theory; quantum Hall effect

65M22: Numerical solution of discretized equations for initial value and initial-boundary value problems involving PDEs