Questions tagged [multi-reference]

For questions about electronic structures methods that use excitations from multiple references to model correlation. These are often prefixed with MR (e.g. MR-CC, MR-CI, MR-PT)

1 question with no upvoted or accepted answers
Filter by
Sorted by
Tagged with
8
votes
0answers
57 views

What are the ways to add dynamic correlation to an MCSCF wavefunction?

We recently learned about the many types of MCSCF, which treat "static" electron correlation. There are then many ways to treat further "dynamic" electron correlation to try and ...