Structure updates

[AntObi]

Pull Request Template

Description

• SmactStructures can now be made with pymatgen structures with predecorated oxidation states.

Type of change

• Bug fix (non-breaking change which fixes an issue)
• New feature (non-breaking change which adds functionality)
• This change requires a documentation update

How Has This Been Tested?

Test Configuration:

• Python version: 3.9
• Operating System: WSL2

Reviewers

N/A

Checklist:

• My code follows the style guidelines of this project
• I have performed a self-review of my own code
• I have commented my code, particularly in hard-to-understand areas
• I have made corresponding changes to the documentation
• My changes generate no new warnings
• I have added tests that prove my fix is effective or that my feature works
• New and existing unit tests pass locally with my changes
• Any dependent changes have been merged and published in downstream modules
• I have checked my code and corrected any misspellings

[codecov]

Codecov Report

Merging #154 (c68cb0d) into master (2bdeac6) will decrease coverage by 0.08%.
The diff coverage is 0.00%.

@@            Coverage Diff             @@
##           master     #154      +/-   ##
==========================================
- Coverage   72.96%   72.89%   -0.08%     
==========================================
  Files          24       24              
  Lines        1894     1896       +2     
==========================================
  Hits         1382     1382              
- Misses        512      514       +2     

Files Changed	Coverage Δ
smact/structure_prediction/structure.py	70.14% <0.00%> (-0.71%)	⬇️