Explicitly correlated second-order Møller–Plesset methods with auxiliary basis sets
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1461814
Reference53 articles.
1. Accuracy of atomization energies and reaction enthalpies in standard and extrapolated electronic wave function/basis set calculations
2. A Road Map for the Calculation of Molecular Binding Energies
3. Chemical accuracy from ‘Coulomb hole’ extrapolated molecular quantum-mechanical calculations
4. Basis-set convergence of correlated calculations on water
5. An examination of intrinsic errors in electronic structure methods using the Environmental Molecular Sciences Laboratory computational results database and the Gaussian-2 set
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