NAME
phonopy-propplot - manual page for phonopy-propplot 2.38.1
DESCRIPTION
usage: phonopy-propplot [-h] [--factor FACTOR] [--ymax YMAX] [--ymin YMIN]
- [--tmax TMAX] [--tmin TMIN] [--cv] [-s] [--fe]
-
[-o OUTPUT_FILENAME] [-d] [--gnuplot] [filename ...]
Phonopy propplot command-line-tool
positional arguments:
- filename
-
Filename of phonon thermal properties result (thermal_properties.yaml)
options:
- -h, --help
-
show this help message and exit
- --factor FACTOR
-
Conversion factor of energy unit to internal electronic energy
- --ymax YMAX
-
Maximum value of y axis
- --ymin YMIN
-
Minimum value of y axis
- --tmax TMAX
-
Maximum value of temperature
- --tmin TMIN
-
Minimum value of temperature
- --cv, --heat_capacity
-
Plot heat capacity
- -s, --entropy
-
Plot entropy
- --fe, --free_energy
-
Plot free energy
- -o, --output OUTPUT_FILENAME
-
Output filename
- -d, --diff
-
Calculate difference
- --gnuplot
-
Damp thermal properties in gnuplot data style