symop_build_spacegroup(1)

symop_build_spacegroup1

Determine a space group from a list of symmetry operators (generators), using the ralf's (ralf grosse-kunstleve) algorithm.

Usage

symop_build_spacegroup < input.symop

symop_build_spacegroup input.symop

symop_build_spacegroup input.symop additional*.symop

Overview

Determine a space group from a list of symmetry operators (generators), using the Ralf's (Ralf Grosse-Kunstleve) algorithm.

Options

-o, --use-optimised-spacegroup-builder
Use the space group builder algorithm optimised
for speed as implemented in the
COD::Spacegroups::Builder module (default).

-s, --use-simple-spacegroup-builder
Use the simpler and slower space group builder
algorithm as implemented in the
COD::Spacegroups::SimpleBuilder module.

--debug
Switch on debug printouts.

--no-debug
Switch of debug printouts (default).

--help, --usage
Output a short usage message (this message) and exit.

--version
Output version information and exit.

Releases

4 releases since Debian 10 (Buster); the text changed 2 times.

  1. 10
  2. 11–12
  3. 13

Reporting bugs

Report symop_build_spacegroup bugs using e-mail: [email protected]

From cod-tools 3.11.0+dfsg-1 in Debian 13 (Trixie). Parsed by carta from the page's man source.