- Description
- Availability
- Examples
Description
This method keyword requests a semi-empirical calculation using the CNDO Hamiltonian [Pople66]. No basis set keyword should be specified.
Availability
Energies, pseudo-analytic gradients, and numerical frequencies.
Examples
The CNDO energy appears in the output file as follows:
SCF Done: E(UCNDO) = -8.08016620373 A.U. after 11 cycles
The energy is as defined by the CNDO model.
- Description
- Availability
- Examples
This method keyword requests a semi-empirical calculation using the CNDO Hamiltonian [Pople66]. No basis set keyword should be specified.
Energies, pseudo-analytic gradients, and numerical frequencies.
The CNDO energy appears in the output file as follows:
SCF Done: E(UCNDO) = -8.08016620373 A.U. after 11 cycles
The energy is as defined by the CNDO model.
Last updated on: 05 January 2017. [G16 Rev. C.01]
