SYMOPS(1) | General Commands Manual | SYMOPS(1) |
symops - print out symmetry operators for a given space group, or print out those symmetry operators that belong to the group, while diagnosing as errors those operators that do not belong to the group.
symops --options P212121
symops --options P212121 -- -y,-x,z -x,y,z
symops --hall -- '-P 2 2'
symops --hall -- '-P 2 2' "-y,-x,z" "-x,y,z"
Print out symmetry operators for a given space group, or print out those symmetry operators that belong to the group, while diagnosing as errors those operators that do not belong to the group.
-q, --quiet
Do not output recognised operator names (default).
-v, --verbose
Print out symmetry operators, negate the '-q' option.
--hall Use Hall symbols for lookup
--hermann-mauguin Use Hermann-Mauguin symbols for lookup
--schoenflies Use Schönflies symbols for lookup
--error-messages
Print error messages about unrecognised symmetry
operators (default).
--no-error-messages
Do not print error messages about missing
symmetry operators, just return a non-zero
status if such are encountered.
--help, --usage
Output a short usage message (this message) and exit.
--version
Output version information and exit.
Report symops bugs using e-mail: cod-bugs@ibt.lt