[QE] section is required only if you use QE (calc_code = QE)
| Name | Value | Default | Description |
|---|---|---|---|
kppvol |
int [int …] | Grid density per Å**(-3) of reciprocal cell in each stage | |
qe_infile |
str | File name of QE input file. | |
qe_outfile |
str | File name of QE output file. |