view article
Figure 4
Speedup of the calculate_qpoint_phonon_modes interpolation function in Euphonic with C extension compared with serial Python for 250 000 Q-points for different materials and numbers of processors. Details of the hardware are given in Section 4.1[link].

Journal logoJOURNAL OF
APPLIED
CRYSTALLOGRAPHY
ISSN: 1600-5767
Volume 55| Part 6| December 2022| Pages 1689-1703
https://doi.org/10.1107/S1600576722009256
Follow J. Appl. Cryst.
Sign up for e-alerts
E-alerts
Follow J. Appl. Cryst. on Twitter
Twitter
Follow us on facebook
Facebook
Sign up for RSS feeds
RSS