diff --git a/conftest.py b/conftest.py index d1268f4..83e15ae 100644 --- a/conftest.py +++ b/conftest.py @@ -7,7 +7,7 @@ @pytest.fixture(scope="function") def cp2k_code(aiida_local_code_factory): return aiida_local_code_factory( - entry_point="cp2k", executable="/opt/conda/envs/cp2k/bin/cp2k.psmp" + entry_point="cp2k", executable="/opt/conda/envs/cp2k/bin/cp2k.psmp", prepend_text='eval "$(command conda shell.bash hook 2> /dev/null)"\nconda activate cp2k\n' )