OPTIONS

FIT
Print out fit coefficients and derivatives and other information relating to these quantities.
HESSIAN
Print out the Hessian.
DENSITIES
Print out information about the various densities used throughout the program. In particular differences between fit and exact densities are printed out.
NUMBERS
Print out the values of the numerous variables used throughout the program in a neat tabular form. For example, the number of basis functions, the number of fit functions, etc.
SYMMETRY
Print out information relating to symmetry. For example the symmetry operators of the symmetry group.
ALL
Print out all of the above plus more.

 

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