Type Aliases
Aliases are available for a large number of job types,
allowing one to pass a str
instead of a type
object, thus simplifying
the input settings for CAT. Aliases are insensitive towards capitalization
(or lack thereof).
A comprehensive list of plams.Job
subclasses and their respective
aliases (i.e. str
) is presented below.
Aliases
ADFJob
="adf"
="adfjob"
AMSJob
="ams"
="amsjob"
UFFJob
="uff"
="uffjob"
BANDJob
="band"
="bandjob"
DFTBJob
="dftb"
="dftbjob"
MOPACJob
="mopac"
="mopacjob"
ReaxFFJob
="reaxff"
="reaxffjob"
Cp2kJob
="cp2k"
="cp2kjob"
ORCAJob
="orca"
="orcajob"
DiracJob
="dirac"
="diracjob"
GamessJob
="gamess"
="gamessjob"
DFTBPlusJob
="dftbplus"
="dftbplusjob"
CRSJob
="crs"
="cosmo-rs"
="crsjob"