/tools/VeloxChem
VeloxChem
VeloxChem/VeloxChem
47 stars9 forksC++Added February 8, 2026
summary
VeloxChem is a Python-based open source quantum chemistry software designed for computing molecular properties and conducting various spectroscopy simulations using response theory. It is optimized for high-performance computing environments.
description
VeloxChem is a Python-based open source quantum chemistry software developed for computing molecular properties and a variety of spectroscopies from response theory.
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