Software

Open-source software developed and maintained by the Evangelista Lab.

Software What It Does Link
Vibemol
Web-based visualization of molecular orbitals (from .cube files) and molecular geometries (from .xyz files). Visit
Forte
A plugin for Psi4 focused on multireference electronic structure methods and strongly correlated chemistry problems. GitHub
Forte2
Next-generation standalone version of Forte for multireference quantum chemistry methods (🚀). GitHub
QForte
A quantum computer emulator and library of software algorithsm for electronic structure on quantum computers. GitHub
Wick&d
A symbolic algebra tool for automated second-quantized operator manipulations and Wick's theorem derivations. GitHub