[Wien] High accuracy calculations
Nils Longshower
nils.longshower at gmail.com
Fri Apr 13 11:33:07 CEST 2018
Hi!
I have a question on some parameters to increase accuracy. In the
supplementary materials for the delta tests, the following parameters are
listed:
* largest l-value of nonspherical Hamiltonian and overlap matrix
* elements inside the spheres largest l-value in expansion of density and
potential
* largest vector in Fourier expansion of charge density
Where do I set these parameters?
Best,
Nils
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