An efficient linear-scaling CCSD(T) method based on local natural orbitals
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4819401
Reference87 articles.
1. Localizability of dynamic electron correlation
2. Orbital-invariant formulation and second-order gradient evaluation in M�ller-Plesset perturbation theory
3. Fourth‐order Mo/ller–Plessett perturbation theory in the local correlation treatment. I. Method
4. Local configuration interaction: An efficient approach for larger molecules
5. Local treatment of electron correlation in coupled cluster theory
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