ipyvasp.widgetsΒΆ

Functions

load_results(paths_list[, exclude_keys])

Loads result.json from paths_list and returns a dataframe.

summarize(files, func, **kwargs)

Apply given func to each file in files and return a dataframe of the results.

Classes

BandsWidget(self, files[, height, store_clicks])

Visualize band structure from VASP calculation.

Files(self[, path_or_files, glob, exclude, ...])

Creates a Batch of files in a directory recursively based on glob pattern or given list of files.

KPathWidget(self, files[, height])

Interactively bulid a kpath for bandstructure calculation.

PropsPicker(self[, system_summary, N])

A widget to pick atoms and orbitals for plotting.