Publications

Dewar, M. J. S.; Thiel, W. Ground States of Molecules. 39. MNDO Results for Molecules Containing Hydrogen, Carbon, Nitrogen, and Oxygen. Journal of the American Chemical Society 1977, 99, 4907–4917.

Dewar, M. J. S.; Thiel, W. Ground States of Molecules. 38. The MNDO Method. Approximations and Parameters. Journal of the American Chemical Society 1977, 99, 4899–4907.

Dewar, M. J. S.; Thiel, W. A Semiempirical Model for the Two-Center Repulsion Integrals in the NDDO Approximation. Theoretica Chimica Acta 1977, 46, 89–104.

Dewar, M. J. S.; Thiel, W. MINDO/3 Study of the Addition of Singlet Oxygen (¹Δ_gO₂) to 1,3-Butadiene. Journal of the American Chemical Society 1977, 99, 2338–2339.