On November twelfth, we will be hosting a webinar about the BigDFT code entitled The Flexibilities of Wavelets for Electronic Structure Calculations in Large Systems.
An article I wrote for The Sankei News called "The Appeal of Chemistry You Can Do At Home" has been published.
A recent update to the gfortran program is breaking compiliation of many legacy software packages. I will describe the underlying cause and possible mitigation strategies.
py3Dmol is a convenient python model for visualizing molecules inside python notebooks. Here I will provide a tutorial for using py3Dmol, including some advanced features.
The ongoing COVID-19 pandemic provides some opportunity to explore discrete event modelling with python.