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CanTherm completes calculations in a matter of seconds, but I think there is potential for it to be done a lot faster. I'm guessing the limiting step is the diagonalization of the Hamiltonian matrix to get energy eigenvalues. Perhaps we could speed this up through cythonizing the code?
The text was updated successfully, but these errors were encountered:
CanTherm completes calculations in a matter of seconds, but I think there is potential for it to be done a lot faster. I'm guessing the limiting step is the diagonalization of the Hamiltonian matrix to get energy eigenvalues. Perhaps we could speed this up through cythonizing the code?
The text was updated successfully, but these errors were encountered: