MaterialsAtlas App · DFT Calculation Tools
DFT Calculation Flow Generator
Generate multi-step DFT workflow directories such as relax-static-bands-DOS from one uploaded structure.
About this app
Generate multi-step DFT workflow directories such as relax-static-bands-DOS from one uploaded structure.
MaterialsAtlas apps are browser-based materials science tools for composition checks, structure analysis, screening, prediction, visualization, and research workflows.