atomec-project / atoMEC

Python-based average-atom code for simulations of high energy density phenomena such as in warm dense matter.
https://atomec-project.github.io/atoMEC/
BSD 3-Clause "New" or "Revised" License
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New implementation with fp options seems unstable #193

Closed timcallow closed 1 year ago

timcallow commented 1 year ago

The implementation using 32 bit precision, whilst working ok for the tests, seems to be unstable for certain configurations. This isn't a big deal since most people will still use floating point 64. What's more worrying is that using fp64 seemed to throw some issues, even though this should be identical to the dev branch.

timcallow commented 1 year ago

This was addressed by PR #200