Efficient and accurate local single reference correlation methods for high-spin open-shell molecules using pair natural orbitals
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.3663855
Reference84 articles.
1. Dealing with Complexity in Open-Shell Transition Metal Chemistry from a Theoretical Perspective: Reaction Pathways, Bonding, Spectroscopy, And Magnetic Properties
2. A thorough benchmark of density functional methods for general main group thermochemistry, kinetics, and noncovalent interactions
3. Accurate Theoretical Chemistry with Coupled Pair Models
4. Density Functionals with Broad Applicability in Chemistry
5. Efficient and Accurate Double-Hybrid-Meta-GGA Density Functionals—Evaluation with the Extended GMTKN30 Database for General Main Group Thermochemistry, Kinetics, and Noncovalent Interactions
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