The Training Course will be held at MBN Research Center, Altenhöferallee 3, 60438 Frankfurt am Main, Germany.
October 8, 10:00 - 15:00, Meeting room
| 10:00-10:15 | Training Course Opening |
| 10:15-11:00 | Basics of MBN Explorer Short description of main features of MBN Explorer: universality, tuneable force fields, multiscale approach, computational efficiency, etc. |
| 11:00-11:30 | Setting up the calculation Specification of input files and formats, and instructions on how to run the program |
| 11:30-12:00 | MBN Studio An introduction to the graphical interface for MBN Explorer |
| 12:00-12:30 | Coffee break |
| 12:30-13:00 | Overview of the examples library Overview of the MBN Explorer examples library, which contains the trial case studies representing certain physical experiments and demonstrating capacities of the program |
| 13:00-13:30 | Gases, liquids, crystals Description of setting up simulations of gaseous, liquid and crystalline media with MBN Explorer |
| 13:30-14:15 | Atomic clusters and nanoparticles Description of setting up calculations involving atomic clusters and nanoparticles. |
| 14:15-15:00 | Collision processes MD simulation of dynamical processes occurring in organic and inorganic materials |
October 9, 10:00 - 14:30, Meeting room
| 10:00-10:45 | Thermo-mechanical properties of materials Investigation of mechanical properties of crystalline, nanostructured and amorphous materials by means of MD simulations of the nanoindentation process |
| 10:45-11:30 |
Pattern formation and evolution Application of the stochastic Monte-Carlo-based dynamics for the analysis of fractal growth and post-growth relaxation processes. |
| 11:30-12:00 | Coffee break |
| 12:00-12:45 |
Biomolecular damage: Thermo-mechanical mechanism Exploration of dynamical processes related to the thermo-mechanical damage of molecular and biomolecular systems |
| 12:45-13:30 |
Nanostructured materials Exploration of dynamical processes related to the thermo-mechanical damage of molecular and biomolecular systems |
| 13:30-14:15 |
Propagation of particles through medium MD simulations of propagation of particles in various media, such as heterocrystalline structures, bent crystals, amorphous materials, solids, nanotubes, biological environment, etc. |
| 14:15-14:30 | Tutorial Closing and Concluding Remarks |