software . 2017

Pybinding V0.8.0: A Python Package For Tight-Binding Calculations

Moldovan, Dean; Anđelković, Miša; Peeters, Francois;
Open Source
  • Published: 27 May 2017
  • Publisher: Zenodo
Abstract
<p>Pybinding is a Python package for numerical tight-binding calculations in solid state physics. The main features include:</p> <ul> <li> <p><strong>Declarative model construction</strong> - The user just needs to describe <em>what</em> the model should be, but not <em>how</em> to build it. Pybinding will take care of the numerical details of building the Hamiltonian matrix so users can concentrate on the physics, i.e. the quantum properties of the model.</p> </li> <li> <p><strong>Fast compute</strong> - Pybinding's implementation of the kernel polynomial method allows for very fast calculation of various physical properties of tight-binding systems. Exact diag...
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doi: 10.5281/zenodo.56818 , 10.5281/zenodo.569848 , 10.5281/zenodo.4010216 ,
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Subjects
free text keywords: tight-binding, solid-state physics, python, code, Biophysics, Biochemistry, Genetics, Physiology, Science Policy, 69999 Biological Sciences not elsewhere classified, 80699 Information Systems not elsewhere classified, 110309 Infectious Diseases, Cell Biology
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Science and Innovation Policy Studies
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