Thermochemistry calculation exception

[t-young31]

Closes #165

[codecov]

Codecov Report

Merging #166 (2e895e2) into v1.3.0 (4b400e0) will decrease coverage by 0.19%.
The diff coverage is 96.99%.

@@            Coverage Diff             @@
##           v1.3.0     #166      +/-   ##
==========================================
- Coverage   96.60%   96.41%   -0.20%     
==========================================
  Files         104      110       +6     
  Lines       11293    11684     +391     
==========================================
+ Hits        10910    11265     +355     
- Misses        383      419      +36     

Flag	Coverage Δ
unittests	96.41% <96.99%> (-0.20%)	⬇️

Flags with carried forward coverage won't be shown. Click here to find out more.

Impacted Files	Coverage Δ
autode/hessians.py	97.51% <75.00%> (-2.06%)	⬇️
autode/methods.py	41.30% <81.81%> (-58.70%)	⬇️
autode/wrappers/G09.py	88.92% <86.90%> (-1.37%)	⬇️
autode/wrappers/methods.py	94.87% <94.87%> (ø)
autode/opt/optimisers/base.py	98.65% <97.36%> (-0.83%)	⬇️
autode/wrappers/NWChem.py	88.66% <97.36%> (-2.24%)	⬇️
autode/calculations/executors.py	97.50% <97.50%> (ø)
autode/wrappers/QChem.py	96.77% <97.91%> (-0.87%)	⬇️
autode/wrappers/MOPAC.py	93.84% <98.24%> (+0.22%)	⬆️
autode/calculations/calculation.py	99.30% <99.30%> (ø)
... and 41 more

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