Gaussian 03 Online Manual
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AM1This method keyword requests a semi-empirical calculation using the AM1 Hamiltonian [43,48,49,53,54,397,398,399,400,401,402]. No basis set keyword should be specified. Energies, "analytic" gradients, and numerical frequencies. The AM1 energy appears in the output file as follows (followed by the x, y, and z components of the dipole moment): Energy= -.091965532835 NIter= 10. Dipole moment= .000000 .000000 -.739540 The energy is as defined by the AM1 model. Note that energy differences computed from the values in semi-empirical calculations are in Hartrees and may be compared directly with energy differences computed from jobs using other methods. |