RESTART_INFO

This section provides information about old force-mixing indices and labels, for restarts. [Edit on GitHub]

Keywords

• INDICES

• LABELS

Keyword descriptions

INDICES

Type: integer[ ]
Repeatable: yes
Usage: INDICES 1 2 …

Description: Indices of atoms in previous step QM regions. [Edit on GitHub]

LABELS

Type: integer[ ]
Repeatable: yes
Usage: LABELS 1 1 …

Description: Labels of atoms in previous step QM regions. [Edit on GitHub]