Man page - gaussian_analyzer(1)

Packages contas this manual

Package: python3-pymatgen
apt-get install python3-pymatgen

Manuals in package:

gaussian_analyzer(1)
feff_plot_dos(1)
get_environment(1)
feff_plot_cross_section(1)
pmg(1)

Documentations in package:

python3-pymatgen

Manual

GAUSSIAN_ANALYZER(1)

User Commands

GAUSSIAN_ANALYZER(1)

NAME

gaussian_analyzer - pymatgen

DESCRIPTION

usage: gaussian_analyzer [-h] [-v] [-f] [dir ...]

Convenient Gaussian run analyzer which can recursively go into a directory to search results. Author: Shyue Ping Ong Version: 1.0 Last updated: Jul 6 2012

positional arguments:

dir: directory to process

optional arguments:

-h, --help: show this help message and exit
-v, --verbose: Verbose mode. Provides detailed output on progress.
-f, --force: Force reanalysis, instead of reusing gaussian_analyzer_data.gz.

December 2020

pymatgen