I am getting the following error while running tests for ase.
About to run pytest with these parameters:
-v
–numprocesses=32
================================================================ test session starts =================================================================
platform linux – Python 3.8.3, pytest-5.4.3, py-1.9.0, pluggy-0.13.1 – /home/19ph90j04/anaconda3/bin/python
cachedir: .pytest_cache
Libraries
ase-3.21.1 /home/19ph90j04/anaconda3/lib/python3.8/site-packages/ase
numpy-1.18.5 /home/19ph90j04/anaconda3/lib/python3.8/site-packages/numpy
scipy-1.5.0 /home/19ph90j04/anaconda3/lib/python3.8/site-packages/scipy
matplotlib-3.2.2 /home/19ph90j04/anaconda3/lib/python3.8/site-packages/matplotlib
spglib-1.16.1 /home/19ph90j04/anaconda3/lib/python3.8/site-packages/spglib
ase_ext not installed
flask-1.1.2 /home/19ph90j04/anaconda3/lib/python3.8/site-packages/flask
psycopg2 not installed
Calculators
Config: No configuration file specified
Datafiles: ase-datafiles package not installed
[ ] abinit not installed
[ ] asap not installed
[ ] cp2k not installed
[ ] dftb not installed
[ ] dftd3 not installed
[ ] elk not installed
[ ] espresso not installed
[ ] exciting not installed
[ ] gpaw not installed
[ ] gromacs not installed
[ ] lammpslib not installed
[ ] lammpsrun not installed
[ ] nwchem not installed
[ ] octopus not installed
[ ] openmx not installed
[ ] siesta not installed
[ ] vasp not installed
-
Use --calculators option to select calculators.
-
See “ase test --help-calculators” on how to configure calculators.
-
This listing only includes external calculators known by the test
system. Others are “configured” by setting an environment variable
like “ASE_xxx_COMMAND” in order to allow tests to run. Please see
the documentation of that individual calculator.
rootdir: /home/19ph90j04/anaconda3/lib/python3.8/site-packages/ase/test, inifile: pytest.ini
plugins: xdist-2.2.1, mock-3.6.1, forked-1.3.0
gw0 I / gw1 I / gw2 I / gw3 I / gw4 I / gw5 I / gw6 I / gw7 I / gw8 I / gw9 I / gw10 I / gw11 I / gw12 I / gw13 I / gw14 I / gw15 I / gw16 I / gw17 I [gw0] linux Python 3.8.3 cwd: /home/19ph90j04/anaconda3/lib/python3.8/site-packages/ase/test
#####################3#####
INTERNALERROR> File “/home/19ph90j04/.local/lib/python3.8/site-packages/xdist/dsession.py”, line 112, in pytest_runtestloop
INTERNALERROR> self.loop_once()
INTERNALERROR> File “/home/19ph90j04/.local/lib/python3.8/site-packages/xdist/dsession.py”, line 135, in loop_once
INTERNALERROR> call(**kwargs)
INTERNALERROR> File “/home/19ph90j04/.local/lib/python3.8/site-packages/xdist/dsession.py”, line 175, in worker_workerfinished
INTERNALERROR> self._active_nodes.remove(node)
INTERNALERROR> KeyError:
Can somebody help me out? One more thing. If someone using ase for calculating transport properties using BoltzTrap and VASP., I am getting this error:
My second issue is:
nelect=calc.read_number_of_electrons()
AttributeError: ‘Vasp’ object has no attribute ‘read_number_of_electrons’
I guess this is related to ase