Boltztrap2 manual

 

 

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BoltzTraP2 provides a numerically stable and efficient method for obtaining analytic representations of electronic bands based on density-functional-theory BoltzTraP2. A modern tool for modern workflows. Algorithm. Including the momentum matrix elements. Command-line interface and Python3 library: CoSb3. Here, I shall describe the way I installed BoltzTraP2 in my laptop. Hope you will be able to install BoltzTraP2 following the above instructions.BoltzTraP2 is a software package for calculating a smoothed Fourier source with a python setup.py install command, and no previous manual configuration. Such a repository is known as a feedstock. A feedstock is made up of a conda recipe (the instructions on what and how to build the package) and the necessary BoltzTraP2 is a modern implementation of the smoothed Fourier interpolation algorithm for electronic bands that formed the base of the original and widely

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