A standalone tutorial for `TB_to_sympy`.#16

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Collins-kariuk:feature/SymPyfy-analytic-expresser

Commits on Oct 3, 2023

Included the sympyfy function alongside its dependencies

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Create .DS_store

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Deleted the notebook containing the sympyfy function

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Started working on the tutorial

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Added DS Store (folder metadata) to gitignore

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Wrote the heading and first text cell

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Wrote about sympy's parameters and TB Hamiltonian

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Finalized first draft

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Finalized first draft of tutorial. Added example output and conclusion.

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Amended the statement that the TB model is only suitable for weakly-correlated systems.

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deleted the HTML import

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Cut out the section on calling the function on the Strontium compound.

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Added the _centres.xyz file for La2CuO4

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Heavily changed the tutorial according to Olivier's recs. Check the description:

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Added the reason why the Hamiltonian is 1-by-1

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Made some changes to the introduction and introduced a band structure of the full vs cutoff model of the Lanthanum cuprate compound

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Added La2CuO4 band structure comparing full W90 model vs cutoff model

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Deleted this because it is based off wrong parameters

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Showed how I call the model and included additional band structure figure (at 0.01 eV min_hopping_norm)

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Changed the form of the Hamiltonian equation and implemented reductions to the text in the introduction

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Created a python file containing the TB_to_sympy function

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included the necessary dependencies

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Made a figure showing band structure of lanthanum cuprate at 2 different energy cutoffs

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Cut down on the text and merged the 2 band structure images

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chopping down unnecessary comments and words in docstring

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changed the location of where I import sympy to inside the function

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changed the order for one of the sentences to promote better flow in the tutorial

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Succinctly phrased the title and some parts of the introduction to clearly convey the message

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changed the name of the first parameter and changed some variable names accordingly

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Added figure that compares minimal models of La2CuO4

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Added notes to intro (from poster) and replaced outdated minimal model figure

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Finished first draft of the section on comparing minimal models

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No longer needed

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Rewrote H(k)

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No longer needed

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Created a Python file from which we can call our main function from the tutorial notebook

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Improved how we get the plot by getting rid of the inefficient function by replacing it with a for loop that basically does the same plotting work for us

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Go rid of remaining \bolds

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Updating the calling of TB_to_sympy

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Update Hamiltonian expression & importations

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remove TB_to_sympy.py file and use triqs function
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update tutorial with triqs module
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remove gitignore changes
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remove unneccesary files
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corrections for tutorial
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Commits on Dec 22, 2023