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Results tagged with coupled-cluster
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user 70
For questions related to the Coupled Cluster electronic structure method.
11
votes
What is the largest system that has been studied by the coupled cluster method?
I’ll expand on this later but here is the abbreviated version.
CTF
The CTF code can do very large iterative CCSD and CCSDT using a dense spin-orbital formalism.
CCSD up to 55 (50) water molecules with …
- 310