Xing Wang
Xing Wang
```python import ipywidgets as ipw from ase.build import molecule from weas_widget import WeasWidget tab_contents = ['H2O', 'NH3', 'CH4'] children = [WeasWidget(from_ase=molecule(name)) for name in tab_contents] tab = ipw.Tab() tab.children =...
When showing the index of the atoms, in Python, the index starts from 0, while in code (like QuantumESPRESSO) written in Fortron, it starts at 1. It is good to...
Here, I list the features that are considered to be added in the future. ## Features must have - [ ] display as a HTML file - [ ] add...
One can open the web console using: Developer: Open Webview Developer Tools from the command palette
- surface builder - nanopaticle - Reciprocal space - lattice plane
For example, I only want to show the top layer of a surface.
For TiO2 set ``` avr.modelSticks = [1, 1, 1, 1, 0, 0]; ``` and draw polyhedra. It show it has four neighbor, but two are duplidate.