Ionization energies of azines from green's function method in semiempirical AM1 approximation

Development and use of quantum mechanical molecular models. 76. AM1: a new general purpose quantum mechanical molecular model

Michael J. S. Dewar, Eve G. Zoebisch, Eamonn F. Healy et al. · Journal of the American Chemical Society · 1985 · 13.1K citations

Engineering, Altmetric Attention Score, Molecular Biology +18

Ground states of molecules. 38. The MNDO method. Approximations and parameters

Michael J. S. Dewar, Walter Thiel · Journal of the American Chemical Society · 1977 · 5.1K citations

Mndo Method, Engineering, Chemical Analysis +21

Computational methods for the one-particle green's function

W. von Niessen, J. Schirmer, Lorenz S. Cederbaum · Computer Physics Reports · 1984 · 1.1K citations

Numerical Analysis, One-particle Green, Engineering +8

One-body Green's function for atoms and molecules: theory and application

Lorenz S. Cederbaum · Journal of Physics B Atomic and Molecular Physics · 1975 · 564 citations

Engineering, Self-energy Part, Excitation Energy Transfer +19

HAM/3, a semi-empirical MO theory. I. The SCF method

L. Åsbrink, C. Fridh, E. Lindholm · Chemical Physics Letters · 1977 · 145 citations

Numerical Analysis, Engineering, Energy Minimization +2