FIX: fixed bug in write_file() routine in Aims calculator (!686) · Merge requests · ase / ase

Simon P. Rittmeyer requested to merge simonrittmeyer/ase:aims into master Dec 07, 2017

This commit fixes a bug in the FHI aims calculator for non-periodic systems introduced with commit 69f4e6a2. This caused even the simple test case on the home page to fail. Issue was positional ordering of arguments.

FIX: fixed bug in write_file() routine in Aims calculator

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