ChemistryAtlas Software and Tool
Quantum ESPRESSO
Quantum chemistry enginesOpen/freechemistry softwareplane-wave DFTperiodic systemsphononsmaterials
Open-source plane-wave DFT suite for electronic structure, phonons, surfaces, and periodic condensed-phase chemistry.
Primary category: Quantum chemistry engines.
Access model: Open/free.
Curated because it is commonly encountered in chemistry research, teaching, analysis, or computational workflows.
Citation: Software resource: Quantum ESPRESSO