Size-consistent wave functions for bond-breaking: the equation-of-motion spin-flip model
By Anna I. Krylov. 2001
387 citations recorded by the source corpus.
Subfields: Atomic and Molecular Physics, and Optics, Spectroscopy
View Paper: https://www.semanticscholar.org/paper/6b624870e2608dfcb04c4f48b3b01dd8e6bb9293
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In Atomic and Molecular Physics, and Optics
In Spectroscopy
Citations in the corpus
- Equation-of-motion coupled-cluster methods for open-shell and electronically excited species: the Hitchhiker's guide to Fock space. (2008, methodology): “The ability of SF to tackle diradical states can be exploited to describe bond breaking (42, 68).”