vibyverse/vibe-qc
vibe-qc — a quantum-chemistry code for molecules and solids: Hartree-Fock, DFT, MP2 and analytic gradients over a Python frontend and a C++17 core.
GitHub repository with 8 stars and 1 forks.
Language: Python
Topics: computational-chemistry, cpp, density-functional-theory, hartree-fock, python, quantum-chemistry