Hi!
I try to calculate plasma frequency for gold with the exciting code. The experimental value is ~ 8.7-8.9 eV, FHI-aims and VASP give ~8.4-8.6 eV. However, the value obtained with exciting is 7.4 eV. Could you help me with that issue please?
P.S. Apologies for attaching the input.xml in such a way, unfortunately I cannot enclose the file. Hope it would work.
https://drive.google.com/file/d/1pXkh95-PxjwnB7Uxl3tGybV2P5UCiR_a/view?usp=sharing
Hi Maria,
Santiago has indicated that he has a fix to this (it’s a bug). I’ve asked him to open a merge request. Once he’s done that, I can push the changes to the public release on Github.
In the future, please use the Upload button to add files, or just copy/paste into the question. Once you remove the files from your google drive, the information is lost.
Cheers,
Alex
Hi Maria,
The patch has now been made. Please try it out and let us know if there are any problems.
Cheers,
Alex