I've written the skeleton for the LMV solver in the lmv_dev branch and ideally it should be working and yet the outer cycle loop seems to diverge (while the inner cycle NR loop converges really quickly... maybe too quickly).
I don't have much time to address and spend more time on this at the moment, but leaving this issue for myself or anyone else interested in RISM and numerical methods.
I've written the skeleton for the LMV solver in the lmv_dev branch and ideally it should be working and yet the outer cycle loop seems to diverge (while the inner cycle NR loop converges really quickly... maybe too quickly).
I don't have much time to address and spend more time on this at the moment, but leaving this issue for myself or anyone else interested in RISM and numerical methods.