Try to solve issue #70 and #47

MineralsCloud / qha

A Python package for calculating thermodynamic properties under quasi-harmonic approximation, using data from ab-initio calculations

https://mineralscloud.github.io/qha/

GNU General Public License v3.0

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Try to solve issue #70 and #47 #71

Closed singularitti closed 5 years ago

singularitti commented 5 years ago

mpmath is easier to install for Windows users and compatible with Python 3.7.3 (unlike bigfloat, not working with 3.7.3), thus we could have one more version of Python supported.

restyled-io[bot] commented 5 years ago

Hey there-

I'm a bot, here to let you know that some code in this PR might not match the team's automated styling. I ran the team's auto-reformatting tools on the files changed in this PR and found some differences. Those differences can be seen in #72.

Please see that Pull Request's description for more details.

singularitti commented 5 years ago

Could anyone of you help to test whether this branch (develop) is giving the same result as we used bigfloat? @tianqin91 @chazeon @underhill1886 I want to deprecate bigfloat and move to mpmath.