FreeBSD Manual Pages
OCT-RUN_PERIODIC_TABLE(1) octopus documentation OCT-RUN_PERIODIC_TABLE(1) NAME oct-run_periodic_table - run octopus for atoms SYNOPSIS oct-run_periodic_table [ option ]... DESCRIPTION This script is one of the octopus utilities. Simple script to run octopus for all atoms in the periodic table for which pseudopotentials are available. -h Show this message. -n Run in dry-run mode (show what would be executed). -s species Run octopus for given species. -a Run octopus for all atoms. -r Do a restart, i.e. do not use fromScratch=yes. -t temperature Run with electronic temperature. -e no_states Use extra states. -x octopus_executable -d defaults_file_for_pseudopotentials The man pages of octopus and of the auxiliary octopus sub-programs (oct-something) are not intended to contain the documentation of the programs, but only their basic description. For where to find more documentation, see the "SEE ALSO" section below. EXAMPLES The following command would run the octopus executable to calculate the He atom. prompt> oct-run_periodic_table -s He -x octopus AUTHOR Written by H. Appel. REPORTING BUGS Report bugs to <appel@physik.fu-berlin.de>. COPYRIGHT Copyright (C) 2005 H. Appel. This is free software; see the source for copying conditions. There is NO warranty; not even for MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. SEE ALSO The largest source of documentation is the octopus website: http://octopus-code.org. perl v5.36.3 2024-12-17 OCT-RUN_PERIODIC_TABLE(1)
NAME | SYNOPSIS | DESCRIPTION | EXAMPLES | AUTHOR | REPORTING BUGS | COPYRIGHT | SEE ALSO
Want to link to this manual page? Use this URL:
<https://man.freebsd.org/cgi/man.cgi?query=oct-run_periodic_table&sektion=1&manpath=FreeBSD+Ports+14.3.quarterly>