Biscotti

Because sometimes you want something to pair with your Espresso

Biscotti is a python package designed to interface with the Quantum Espresso code (v5.3 supported)

This package can:

• Prepare calculation input files for pw.x, pp.x, and others
• Validate input files, check for incorrect and missing flags
• Analyze and parse output files
• Manage and manipulate atomic structures

Dependancies:

• Python3
• numpy
• matplotlib

And some normally built-in libraries such as:

• os
• sys
• re
• logging
• collections
• hashlib
• glob
• smtplib