xtp_run(1)

xtp_run1

Part of the votca package

Usage

xtp_run [OPTIONS]

xtp_run [--help]

Overview

Runs excitation/charge transport calculators

Options

Allowed options:

-h [ --help ] display this help and exit
--verbose be loud and noisy
--verbose1 be very loud and noisy
-v [ --verbose2 ] be extremly loud and noisy
-o [ --options ] arg Calculator user options.
-t [ --nthreads ] arg (=1) number of threads to create
-e [ --execute ] arg Name of Calculator to run
-l [ --list ] Lists all available Calculators
-d [ --description ] arg Short description of a Calculators
-c [ --cmdoptions ] arg Modify options via command line by e.g. '-c
xmltag.subtag=value'. Use whitespace to
separate multiple options
-p [ --printoptions ] arg Prints xml options of a Calculator
-f [ --file ] arg hdf5 state file, *.hdf5
-i [ --first-frame ] arg (=0) start from this frame
-n [ --nframes ] arg (=1) number of frames to process
-s [ --save ] arg (=1) whether or not to save changes to state file

Releases

3 releases since Debian 11 (Bullseye); the text changed 2 times.

  1. 11
  2. 12
  3. 13

--help until Debian 11 (Bullseye); --list until Debian 11 (Bullseye); --man until Debian 11 (Bullseye); --tex until Debian 11 (Bullseye); --verbose until Debian 11 (Bullseye); --verbose1 until Debian 11 (Bullseye); --verbose2 until Debian 11 (Bullseye); -h until Debian 11 (Bullseye); -l until Debian 11 (Bullseye); -v until Debian 11 (Bullseye).

Authors

Written and maintained by the VOTCA Development Team <[email protected]>

From votca 2024.2-4 in Debian 13 (Trixie). Parsed by carta from the page's man source.