I’ve recently been reading the 2011 Inorg. Chem. paper “Data Mined Ionic Substitutions for the Discovery of New Compounds” by Hautier et al. and really like the concept and am impressed by the implementation into the MP Structure Predictor.
I was getting on quite well with it, but now for whatever ion composition I submit I eventually just get ‘Error’ as opposed to ‘Completed’ and there’s no way to get an elaboration on the nature of the error as far as I can tell. Any insight would be appreciated!