Paul von Ragué Schleyer

Hyperconjugation effect in substituted methyl boranes: an orbital deletion procedure analysis.

Yirong Mo, Haijun Jiao, Y. Mo, 2004, The Journal of organic chemistry.

Systematic errors in computed alkane energies using B3LYP and other popular DFT functionals.

Clémence Corminboeuf, Matthew D. Wodrich, C. Corminboeuf, 2006, Organic letters.

An energetic measure of aromaticity and antiaromaticity based on the Pauling-Wheland resonance energies.

Yirong Mo, Y. Mo, Paul von Ragué Schleyer, 2006, Chemistry.

How accurate are DFT treatments of organic energies?

Clémence Corminboeuf, Matthew D. Wodrich, P. Schreiner, 2007, Organic letters.

Chemical evolution: The mechanism of the formation of adenine under prebiotic conditions

Paul von Ragué Schleyer, P. von Ragué Schleyer, Katayoun Najafian, 2007, Proceedings of the National Academy of Sciences.