.. DO NOT EDIT. .. THIS FILE WAS AUTOMATICALLY GENERATED BY SPHINX-GALLERY. .. TO MAKE CHANGES, EDIT THE SOURCE PYTHON FILE: .. "examples\04-fermi3d\plot_fermi3d_spin_texture.py" .. LINE NUMBERS ARE GIVEN BELOW. .. only:: html .. note:: :class: sphx-glr-download-link-note :ref:`Go to the end ` to download the full example code. .. rst-class:: sphx-glr-example-title .. _sphx_glr_examples_04-fermi3d_plot_fermi3d_spin_texture.py: .. _ref_plotting_fermi3d_spin_texture: Plotting fermi3d spin_texture ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ Symmetry does not currently work! Make sure for fermi surface calculations turn off symmetry Plotting fermi3d spin_texture example. First download the example files with the code below. Then replace data_dir below. .. code-block:: :caption: Downloading example data_dir = pyprocar.download_example(save_dir='', material='Fe', code='vasp', spin_calc_type='non-colinear', calc_type='fermi') .. GENERATED FROM PYTHON SOURCE LINES 23-25 .. code-block:: Python # sphinx_gallery_thumbnail_number = 1 .. GENERATED FROM PYTHON SOURCE LINES 26-31 .. code-block:: Python import pyvista # You do not need this. This is to ensure an image is rendered off screen when generating exmaple gallery. pyvista.OFF_SCREEN = True .. GENERATED FROM PYTHON SOURCE LINES 32-33 importing pyprocar and specifying local data_dir .. GENERATED FROM PYTHON SOURCE LINES 33-51 .. code-block:: Python import os import pyprocar data_dir = f"{pyprocar.utils.ROOT}{os.sep}data{os.sep}examples{os.sep}Fe{os.sep}vasp{os.sep}non-colinear{os.sep}fermi" # First create the FermiHandler object, this loads the data into memory. Then you can call class methods to plot # Symmetry only works for specfic space groups currently. # For the actual calculations turn off symmetry and set 'apply_symmetry'=False fermiHandler = pyprocar.FermiHandler( code="vasp", dirname=data_dir, apply_symmetry=True) .. rst-class:: sphx-glr-script-out .. code-block:: none WARNING : Fermi Energy not set! Set `fermi={value}`. By default, using fermi energy found in given directory. --------------------------------------------------------------------------------------------------------------- .. GENERATED FROM PYTHON SOURCE LINES 52-56 Spin Texture mode +++++++++++++++++++++++++++++++++++++++ .. GENERATED FROM PYTHON SOURCE LINES 56-62 .. code-block:: Python fermiHandler.plot_fermi_surface(mode="spin_texture", spin_texture=True, arrow_size=0.1, show=True,) .. image-sg:: /examples/04-fermi3d/images/sphx_glr_plot_fermi3d_spin_texture_001.png :alt: plot fermi3d spin texture :srcset: /examples/04-fermi3d/images/sphx_glr_plot_fermi3d_spin_texture_001.png :class: sphx-glr-single-img .. rst-class:: sphx-glr-script-out .. code-block:: none -------------------------------------------------------- There are additional plot options that are defined in a configuration file. You can change these configurations by passing the keyword argument to the function To print a list of plot options set print_plot_opts=True Here is a list modes : plain , parametric , spin_texture , overlay Here is a list of properties: fermi_speed , fermi_velocity , harmonic_effective_mass -------------------------------------------------------- ij,uvwabj->uvwabi .. rst-class:: sphx-glr-timing **Total running time of the script:** (0 minutes 7.507 seconds) .. _sphx_glr_download_examples_04-fermi3d_plot_fermi3d_spin_texture.py: .. only:: html .. container:: sphx-glr-footer sphx-glr-footer-example .. container:: sphx-glr-download sphx-glr-download-jupyter :download:`Download Jupyter notebook: plot_fermi3d_spin_texture.ipynb ` .. container:: sphx-glr-download sphx-glr-download-python :download:`Download Python source code: plot_fermi3d_spin_texture.py ` .. only:: html .. rst-class:: sphx-glr-signature `Gallery generated by Sphinx-Gallery `_