This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| Get the script and the folder for setting up the system in the repository |
quantum-kite
/ twisted_bilayer.py
Created
June 10, 2018 22:02
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| """ Twisted bilayer graphene, loading a predefined lattice | |
| Lattice : Twisted bilayer graphene; | |
| Disorder : None; | |
| Configuration : size of the system flexible, with domain decomposition, periodic boundary conditions, | |
| double precision, automatic scaling; | |
| Calculation : dos; | |
| Modification : magnetic field is off; | |
| """ |
quantum-kite
/ optical_graphene_gauss.py
Last active
June 10, 2018 21:04
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| """ Optical conductivity of disordered graphene lattice | |
| Lattice : Monolayer graphene; | |
| Disorder : Disorder class Gaussian at different sublattices; | |
| Configuration : size of the system 512x512, without domain decomposition (nx=ny=1), periodic boundary conditions, | |
| double precision, manual scaling; | |
| Calculation : dos; | |
| Modification : magnetic field is off; | |
| """ |
quantum-kite
/ haldane.py
Last active
June 10, 2018 18:06
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| """ DOS and DC conductivity of the Haldane model | |
| Lattice : Honeycomb lattice; | |
| Disorder : Disorder class Uniform at different sublattices; | |
| Configuration : size of the system 256x256, with domain decomposition (nx=ny=12), periodic boundary conditions, | |
| double precision, automatic scaling; | |
| Calculation : DOS and conductivity_dc; | |
| Modification : magnetic field is off; | |
| """ |
quantum-kite
/ phosphorene_yy.py
Last active
June 10, 2018 16:29
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| """ Phosphorene conductivity 'yy' | |
| Lattice : Bilayer phosphorene; | |
| Disorder : None; | |
| Configuration : size of the system 512x512, without domain decomposition (nx=ny=1), periodic boundary conditions, | |
| double precision, automatic scaling; | |
| Calculation : singleshot_conductivity_dc; | |
| Modification : magnetic field is off; | |
| """ |
quantum-kite
/ phosphorene_xx.py
Last active
June 10, 2018 16:29
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| """ Phosphorene conductivity 'xx' | |
| Lattice : Bilayer phosphorene; | |
| Disorder : None; | |
| Configuration : size of the system 512x512, without domain decomposition (nx=ny=1), periodic boundary conditions, | |
| double precision, automatic scaling; | |
| Calculation : singleshot_conductivity_dc; | |
| Modification : magnetic field is off; | |
| """ |
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| THIS IS OUR LOGO |
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| """Basic lattice specification for monolayer graphene with nearest neighbor""" | |
| import matplotlib.pyplot as plt | |
| import pybinding as pb | |
| import math | |
| a = 0.24595 # [nm] unit cell length | |
| a_cc = 0.142 # [nm] carbon-carbon distance |
quantum-kite
/ run_example.sh
Last active
June 9, 2018 10:29
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| #!/bin/bash | |
| file_out=example1 # define name of a python script that exports the *.h5 file file | |
| file_in=example1 # define name of an input *.h5 exported from when running previous script file | |
| python ${file_out}.py # make a model | |
| ./KITEx ${file_in}.h5 # run Quantum Kite | |
| ./tools/KITE-tools ${file_in}.h5 # run PostProccesingCode | |
| python plot_dos.py # display the data |
quantum-kite
/ structural_disorder.py
Last active
June 10, 2018 16:29
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| """ Bond disorder | |
| Lattice : Honeycomb 1[nm] interatomic distance and t=1[eV] hopping; | |
| Disorder : StructuralDisorder class bond and vacancy disorder; | |
| Configuration : size of the system 512x512, without domain decomposition (nx=ny=1), periodic boundary conditions, | |
| double precision, manual scaling; | |
| Calculation : dos; | |
| Modification : magnetic field is off; | |
| """ |
NewerOlder