Incremental Scheme for Intermolecular Interactions: Benchmarking the Accuracy and the Efficiency
Author:
Affiliation:
1. Institute for Chemistry, Chemnitz University of Technology, Straße der Nationen 62, 09111 Chemnitz, Germany
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct200686h
Reference112 articles.
1. Semiempirical GGA-type density functional constructed with a long-range dispersion correction
2. Local treatment of electron correlation in coupled cluster theory
3. Low-order scaling local electron correlation methods. I. Linear scaling local MP2
4. Low-order scaling local electron correlation methods. III. Linear scaling local perturbative triples correction (T)
5. A natural linear scaling coupled-cluster method
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