Code sample, preferably able to be copy-pasted and run with no changes
from pyked import ChemKED
from urllib.request import urlopen
import yaml
# load a file
st_link = 'https://raw.githubusercontent.com/pr-omethe-us/PyKED/master/pyked/tests/testfile_st_p5.yaml'
with urlopen(st_link) as response:
testfile_st = yaml.safe_load(response.read())
ck = ChemKED(dict_input=testfile_st)
# convert to a dataframe
pd = ck.get_dataframe()
# but now our rows don't have a reference to what the composition type is!
print(next(pd.iterrows()))
(0, Reference:Volume 159
Reference:Journal Combustion and Flame
Reference:Doi 10.1016/j.combustflame.2011.08.014
Reference:Authors Ivo Stranic
Reference:Detail None
Reference:Year 2012
Reference:Pages 516-527
Apparatus:Kind shock tube
Apparatus:Institution High Temperature Gasdynamics Laboratory, Stanf...
Apparatus:Facility stainless steel shock tube
Chemked Version 0.0.1
Experiment Type ignition delay
File Authors Morgan Mayer
File Version 0
Ar 0.956666667 dimensionless
O2 0.04 dimensionless
T-Butanol 0.003333333 dimensionless
Kind mole fraction
Ignition Delay 347 microsecond
Temperature 1459 kelvin
Pressure 1.6 atmosphere
Equivalence Ratio 0.5
Name: 0, dtype: object)
Thus, we can't re-create the state (because we don't know if it's mass-fractions, mole-fractions, etc.)
Code sample, preferably able to be copy-pasted and run with no changes
Thus, we can't re-create the state (because we don't know if it's mass-fractions, mole-fractions, etc.)
Expected behavior
Include the "Kind" attribute in the data-frame
Actual behavior, including any error messages
Doesn't include the "Kind" attribute
PyKED/ChemKED version, Python version, OS version
latest master, py3.6.8, RHEL7