Update TURBOMOLE calculator
i) Added support to Grimme's dispersion corrections. ii) Updated list of supported functionals to TM v7.7. iii) ASE automatically chooses between aoforce and NumForce to calculate Hessians.
Checklist
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I am familiar with ASE's contribution guidelines. -
Doc strings in code changed in this MR are up to date. -
Unit tests have been added for new or changed code. -
Issue is resolved via "closes #XXXX" if applicable.
Edited by Jose Gamez