energy
Performs a single-point energy calculation. This command can appear in the global context.
Subcommands
Options
name
-
Specify the name of a set of results.
This option is deprecated.
- The type is string
- There is no default value.
print_level
-
Print level.
- The type is int
- There is no default value.
- The value must be one of:
-2
- No output-1
- Minimum output0
- Output that doesn't scale with system size1
- Output that scales linearly with system size2
- (Debugging) output that scales quadratically with system size3
- (Debugging) output that scales cubically with system size