Reference Label Details
Karton 2006A. Karton, E. Rabinovich, J. M. L. Martin, and B. Ruscic, J. Chem. Phys. 125, 144108/1-17 (2006)
W4 Theory for Computational Thermochemistry: In Pursuit of Confident sub-kJ/mol Predictions
Karton 2007A. Karton, B. Ruscic, and J. M. L. Martin, J. Mol. Struct. (TheoChem) 811, 345-353 (2007)
Benchmark Atomization Energy of Ethane: Importance of Accurate Zero-Point Vibrational Energies and Diagonal Born–Oppenheimer Corrections for a ‘Simple’ Organic Molecule
Karton 2011A. Karton, S. Daon, J. M. L. Martin, Chem. Phys. Lett. 510, 165-178 (2011)
W4-11: A High-Confidence Benchmark Dataset for Computational Thermochemistry Derived from First-Principles W4 Data
Karton 2017A. Karton, N. Sylvetsky, and J. M. L. Martin, J. Computat. Chem. 38, 2063-2075 (2017)
W4-17: A Diverse and High-Confidence Dataset of Atomization Energies for Benchmarking High-Level Electronic Structure Methods