Ian Bell

I don't know how you want to handle updates to the repo, but I have put together some encapsulated docker environments that run the simple example. I struggled a bit...

In the Dockerfile, you should consider to add a line right before the thermopack clone that includes an add of metadata coming from github about the repo. In so doing,...

You can (and should) squash the all the run commands at the start of the dockerfile into one command so that intermediate layers are not generated (which makes the image...

Extraction of tokens

4

I wonder how one could extract the tokens from the expression needing to be defined without providing them upfront. For me that would be very useful in the dynamic programming...

Combined gradients

2

I have a function like so: `` f(T,rho,x) `` in which T and rho are scalars and x is a vector. I would like to calculate the combined gradient $$...

Symbol hoisting

1

Fix where symbol hacking occurs Fixes #452

Bug with custom model calculating entropy

7

I am a newbie to pycalphad, but I believe I have run into a problem. I learned later on that calculation of the entropy was already available in the library,...

Surprising default combining rule in association term

3

After quite some investigation my colleague and I figured out what was going on in the association implementation in Clapeyron and we were quite surprised to find that the default...

VT_XXX methods not exported from the main namespace

2

When trying to call one of the VT_XXX methods as described in the docs, that doesn't work unless I prefix the function with ``Clapeyron.`` The docs suggest all the VT_XX...

The "simple example" doesn't re-start the integration at [1,0] for each of the integration methods; each is chained after the one preceding it. This was very confusing when I was...