W3 theory: Robust computational thermochemistry in the kJ/mol accuracy range
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1638736
Reference61 articles.
1. Towards standard methods for benchmark quality ab initio thermochemistry—W1 and W2 theory
2. Assessment of W1 and W2 theories for the computation of electron affinities, ionization potentials, heats of formation, and proton affinities
3. Heats of Formation of Alkali Metal and Alkaline Earth Metal Oxides and Hydroxides: Surprisingly Demanding Targets for High-Level ab Initio Procedures
4. Ab initio total atomization energies of small molecules — towards the basis set limit
5. Basis-set convergence in correlated calculations on Ne, N2, and H2O
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