Examples

This page lists a few examples of visualizations based on chemiscope. Rather than providing a demonstration of a scientifc application, as for the examples on the main page, these examples consist in short Python scripts that demonstrate how to make a chemiscope viewer file that uses some particular features (e.g. atom coloring or shape visualization).

Simple chemiscope input

Simple chemiscope input

Structure-property maps

Structure-property maps

Trajectory plotting

Trajectory plotting

Atom property coloring

Atom property coloring

Shape visualization

Shape visualization

Exploring dataset with chemiscope

Exploring dataset with chemiscope

Advanced dataset exploration

Advanced dataset exploration

Using metatensor models for dataset exploration

Using `metatensor`_ models for dataset exploration

Showing custom bonds using stk

Showing custom bonds using stk