Full implemented wavefunction class should know the following
-MO coefficients
-should be owned by QC_MONTE
-energy class should know what wavefunctions they need to allow dynamic allocation of wavefunctions
-wavefunction variables should never by directly iterated over
Samthos
commented
4 years ago
Full implemented wavefunction class should know the following
-MO coefficients -should be owned by QC_MONTE -energy class should know what wavefunctions they need to allow dynamic allocation of wavefunctions -wavefunction variables should never by directly iterated over