LIST Keywords
This command instructs the program to output additional information. At present, the possible values of Keywords are:
ATOMS |
List of atoms in the unit cell |
DIST value1 value2 value3 |
List of distance of the peaks between value1 and value2. Value3 is the maximum distance for angle calculations In default, value1 = 1.000, value2 = 2.5 Å., value3 = 0.0 Å. |
Example:
LIST atoms
LIST dist 1.8 2.25 0.0