Change Beginning of SCF Iterations Loop

psi4 / psi4numpy

Combining Psi4 and Numpy for education and development.

BSD 3-Clause "New" or "Revised" License

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Closed andyj10224 closed 3 years ago

andyj10224 commented 3 years ago

The line if (scf_iter == MAXITER), on line 458, will never be reached in the UHF tutorial