AbiPy Gallery¶

There are a variety of ways to use the AbiPy post-processing tools, and most of them are illustrated in the examples in this directory.

Remember that one can also generate a jupyter notebook directly from the command line with the abiopen.py script and the command:

abiopen.py FILE -nb

issue

abiopen.py FILE –expose

to generate plots automatically or use one of the options of abiview.py to plot the results automatically.

../_images/sphx_glr_plot_ebands_scatter3d_thumb.png

e-bands scatter3d

../_images/sphx_glr_plot_bz_thumb.png

../_images/sphx_glr_plot_structure_thumb.png

../_images/sphx_glr_plot_ebands_boxplot_thumb.png

Seaborn boxplot

../_images/sphx_glr_plot_gw_spectral_functions_thumb.png

G0W0 spectral function

../_images/sphx_glr_plot_xrd_thumb.png

X-ray diffraction pattern

../_images/sphx_glr_plot_scqpgw_thumb.png

self-consistent GW

../_images/sphx_glr_plot_qps_thumb.png

SIGRES file (GW)

../_images/sphx_glr_plot_wannier90_wout_thumb.png

Wannier90 wout file

../_images/sphx_glr_plot_ddb_asr_thumb.png

Phonon Bands with/without ASR

../_images/sphx_glr_plot_multiple_hist_thumb.png

Multiple Structural relaxations

../_images/sphx_glr_plot_fold2bloch_thumb.png

Unfolding with fold2bloch

../_images/sphx_glr_plot_edos_thumb.png

../_images/sphx_glr_plot_kpath_from_ibz_thumb.png

K-path from IBZ

../_images/sphx_glr_plot_hist_thumb.png

Structural relaxation

../_images/sphx_glr_plot_dfpt_cycle_thumb.png

../_images/sphx_glr_plot_gscycle_thumb.png

Ground-state SCF cycle

../_images/sphx_glr_plot_fermisurface_thumb.png

MgB2 Fermi surface

../_images/sphx_glr_plot_scr_thumb.png

Dielectric function with LFE

../_images/sphx_glr_plot_lobster_files_thumb.png

Lobster COHP/COP/DOS

../_images/sphx_glr_plot_multiple_mdf_thumb.png

Multiple Bethe-Salpeter calculations

../_images/sphx_glr_plot_a2f_thumb.png

Eliashberg function

../_images/sphx_glr_plot_ejdos_thumb.png

Joint Density of States

../_images/sphx_glr_plot_ebands_thumb.png

Band structure plot

../_images/sphx_glr_plot_ebands_edos_thumb.png

../_images/sphx_glr_plot_lobster_cohp_thumb.png

Lobster COHPCAR

../_images/sphx_glr_plot_phonon_pjdos_thumb.png

Projected phonon DOS

../_images/sphx_glr_plot_phthermo_thumb.png

Thermodinamic properties

../_images/sphx_glr_plot_scr_matrix_thumb.png

../_images/sphx_glr_plot_qpconverge_thumb.png

../_images/sphx_glr_plot_phbands_nkpt_tsmear_thumb.png

Multiple phonon bands

../_images/sphx_glr_plot_den_thumb.png

../_images/sphx_glr_plot_funcs_thumb.png

Function1D object

../_images/sphx_glr_plot_efatbands_lm_thumb.png

../_images/sphx_glr_plot_mdf_thumb.png

../_images/sphx_glr_plot_phonons_thumb.png

AlAs Phonon bands

../_images/sphx_glr_plot_phbands_and_dos_thumb.png

Phonon Band structures

../_images/sphx_glr_plot_phonons_lo_to_thumb.png

Phonon Bands with LO-TO

../_images/sphx_glr_plot_gruneisen_thumb.png

Gruneisen parameters

../_images/sphx_glr_plot_ebands_grid_thumb.png

ElectronBandsPlotter

../_images/sphx_glr_plot_edos_vs_broad_thumb.png

Multiple e-DOSes

../_images/sphx_glr_plot_phonon_fatbands_thumb.png

Phonon fatbands

../_images/sphx_glr_plot_wannier90_abiwan_thumb.png

Band structure interpolation with Wannier functions

../_images/sphx_glr_plot_optic_thumb.png

../_images/sphx_glr_plot_phbands_grid_thumb.png

Multiple phonon bands

../_images/sphx_glr_plot_potentials_thumb.png

../_images/sphx_glr_plot_wfk_thumb.png

Wavefunction file

../_images/sphx_glr_plot_ebands_spin_thumb.png

Spin-polarized e-bands

../_images/sphx_glr_plot_eph_from_mp_thumb.png

Electrons and Phonons from the materials project website

../_images/sphx_glr_plot_efatbands_thumb.png

../_images/sphx_glr_plot_efatbands_spin_thumb.png

spin-polarized fatbands

../_images/sphx_glr_plot_qpbands_with_scissor_thumb.png

GW with scissors operator

../_images/sphx_glr_plot_qpbands_with_interpolation_thumb.png

Gallery generated by Sphinx-Gallery