[ase-users] problems with installation
ebruffey at hawaii.edu
ebruffey at hawaii.edu
Thu Jul 27 01:05:41 CEST 2017
Hi all,
So I am running bash on Ubuntu on windows 10 and I used pip install to install ase. I also set my environment variable using
export PYTHONPATH=usr/bin/ase:$PYTHONPATH
I am unsure of how to find the path to the ase command line tools. Also I used ase test and it throws this error. I tried to email the email given but it doesn’t seem to exist. I have only been programming since January of this year so any help would be greatly appreciated!
An exception occurred! Please report the issue to
ase-developer at listserv.fysik.dtu.dk - thanks! Please also report this
if it was a user error, so that a better error message can be provided
next time.Traceback (most recent call last):
File "/usr/bin/ase", line 5, in <module>
main()
File "/usr/lib/python2.7/dist-packages/ase/tasks/main.py", line 87, in main
run()
File "/usr/lib/python2.7/dist-packages/ase/tasks/main.py", line 80, in run
atoms = task.run(args)
File "/usr/lib/python2.7/dist-packages/ase/tasks/molecule.py", line 63, in run
return OptimizeTask.run(self, names)
File "/usr/lib/python2.7/dist-packages/ase/tasks/task.py", line 134, in run
names = self.exclude(names)
File "/usr/lib/python2.7/dist-packages/ase/tasks/task.py", line 115, in exclude
atoms = self.create_system(name)
File "/usr/lib/python2.7/dist-packages/ase/tasks/task.py", line 204, in create_system
system = self.build_system(name)
File "/usr/lib/python2.7/dist-packages/ase/tasks/molecule.py", line 72, in build_system
symbols = string2symbols(name)
File "/usr/lib/python2.7/dist-packages/ase/atoms.py", line 1431, in string2symbols
raise ValueError
ValueError
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