Environ for relaxation calculations

[Johanna W.]

Hello everyone,

I started using environ in the last month and was able to use it successfully within some scf calculations (I am investigating molecular adsorption on a metallic slab system). However, if I try to use environ in relaxation calculations, the calculation crashes almost immediately and the quantum espresso output file remains empty. Has this problem occured before to someone before? Without environ, the relaxation works without problems.

Best wishes and thank you very much

Johanna

[Johanna W.]

Edit: there was an issue in my jobsubmission file - resolving that fixed the problem.