CamCASP/Programming/4
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CamCASP => Programming => Rotations
The theory of integral and MO rotations has been described in Integrals
DALTON
MOs from DALTON don't seem to be rotationally invariant.
CamCASP => Programming => Rotations
The theory of integral and MO rotations has been described in Integrals
MOs from DALTON don't seem to be rotationally invariant.