activity
20172026
most citedElectronic excited states in extreme limits via ensemble density functionals

29 citations · 73 across the 9 of their papers we have counts for

collaborators
Showing 2026Show all

1 paper · 1 filter

physics.chem-ph2026

The Python Simulations of Chemistry Framework: 10 years of an open-source quantum chemistry project

Qiming Sun, Matthew R Hermes, Xiaojie Wu +100

Over the past decade, the Python-based Simulations of Chemistry Framework (PySCF) has developed into a widely used open-source platform for electronic structure theory and quantum…