NAME¶
xtp_run - Part of the VOTCA package
SYNOPSIS¶
xtp_run [OPTIONS]
xtp_run [–help]
DESCRIPTION¶
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