joshgabriel / MPInterfaces

Python package that enables high throughput analysis of interfaces(ligands/solvent/hetero-structures) using VASP, VASPsol and materialsproject tools
MIT License
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Pull request to merge Bitbucket_dev with master to simplify the merge #1

Closed joshgabriel closed 8 years ago

joshgabriel commented 8 years ago

Code integration of twod_materials (credits: Michael Ashton) with mpinterfaces performed on bitbucket. Further testing of streamlining reproducible workflows between packages required