mirror of https://gitlab.com/QEF/q-e.git
![]() See https://stackoverflow.com/questions/50148175/what-does-cd-echo-0-sed-s-1-do-in-bash-script Note: some trailing blanks have been removed as well by the script I used. Use "git diff -b" to see only the true changes. |
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run_example |
README
This example shows how to use pw.x to calculate the total energy and the band structure of Silicon using hybrid HSE functional. Additional k-points along high-symmetry directions are included in the self-consistent calculation with zero weight, using the ADDITIONAL_K_POINTS card. The path is extracted from the results of bands.x using plotbands.x