[CP2K-user] What does MULTIPLICITY 0 means?
Torstein Fjermestad
tfjer... at gmail.com
Mon Apr 29 16:26:24 UTC 2019
Dear all,
In the Cp2k manual, the explanation for the keyword "MULTIPLICITY" is as
follows: "*Default is 1 (singlet) for an even number and 2 (doublet) for an
odd number of electrons."*
But then two lines further down, it says: "Default value: 0"
What does MULTIPLICITY 0 means?
Thanks in advance for your clarification.
Regards,
Torstein
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