2. Modules and Tools

• 2.1. MedeA Overview
• 2.2. InfoMaticA
• 2.3. Other Databases
• 2.4. Building and Structure Editing
• 2.5. Special Builders
• 2.6. Flowcharts
• 2.7. VASP Versions in MedeA
• 2.8. MedeA VASP 5.4
• 2.9. Analysis of Results
• 2.10. Electronics (Fermi Surfaces, Effective Masses and Electronic Transport)
• 2.11. Automated Convergence
• 2.12. MedeA Phonon 2.0
• 2.13. MedeA Gaussian
• 2.14. Morphology
• 2.15. MedeA GIBBS
• 2.16. MOPAC 2009/2012/2016
• 2.17. Transition State Search
• 2.18. MedeA UNCLE
• 2.19. Forcefields
• 2.20. MedeA LAMMPS
• 2.21. Thermal Conductivity
• 2.22. Viscosity
• 2.23. Diffusion
• 2.24. MedeA Forcefield Optimizer
• 2.25. MedeA HT
• 2.26. MedeA QT
• 2.27. MedeA P3C: Polymer Property Prediction Using Correlations
• 2.28. MedeA QSPR: Property Prediction Using Group Contributions
• 2.29. MedeA Deposition