[ase-users] ImportError: No module named build

[Sean Dix]

I am having an error running ASE using the SLURM job manager utility.

when running I get this error:
Traceback (most recent call last):
  File "/var/spool/slurmd/job18115/slurm_script", line 15, in <module>
    from ase.build import fcc111, add_adsorbate, molecule
ImportError: No module named build

I have three other "from ase..” lines that work without failing. This error only occurs when I include the #SBATCH information and submit the job to the scheduler. I can run the job on the head node using "python pureptoh.py" and it builds the POSCAR fine. Please let me know if more information is needed.

system info:
platform        Linux-2.6.32-696.20.1.el6.x86_64-x86_64-with-centos-6.9-Final
python-3.6.3    /usr/local/bin/python3.6
ase-3.15.0      /usr/local/lib/python3.6/site-packages/ase/
numpy-1.14.0    /usr/local/lib/python3.6/site-packages/numpy/
scipy-1.0.0     /usr/local/lib/python3.6/site-packages/scipy/

beginning of script:
#!/usr/bin/env python
#SBATCH -J pureptoh
#SBATCH --time=1000:00:00
#SBATCH -N 1
#SBATCH --ntasks-per-node 20
#SBATCH -o out.o%j
#SBATCH -e err.e%j
#SBATCH --export=ALL
#SBATCH --mail-type=ALL
#SBATCH --mail-user=seantdix at gmail.com

from ase import Atoms, Atom
from ase.calculators.vasp import Vasp
from ase.constraints import FixAtoms
from ase.build import fcc111, add_adsorbate, molecule
from ase.io import write, read



Sean T. Dix
Ph.D. Candidate - Linic Lab
NSF Graduate Research Fellow
Department of Chemical Engineering
University of Michigan, Ann Arbor 



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