Time
|
Duration
|
Type
|
Presenting person
|
Title
|
September 4th, Monday |
|
| 11:00 |
Opening Ceremony - 2nd floor, Small Hall (237) |
| 11:30 |
The Czochralski Award Ceremony |
| 12:30 |
Lunch break |
| 14:00 |
Simulation techniques for bridging length and time scales - Tetsuo Mohri, Véronique Pierron-Bohnes, Tomasz Wejrzanowski |
| 14:00 |
00:30:00 |
Invited oral |
Irina V. Belova |
Bridging different length and time scales in diffusion problems using variable length lattice models |
| 14:30 |
00:15:00 |
Oral |
Marek Danielewski |
Electro-Mechano-Chemistry; Transport Problem in Three Time Scales |
| 14:45 |
00:15:00 |
Oral |
Simon P. Gill |
Concurrent multiscale Kinetic Monte Carlo-continuum models for the evolution of solids via diffusion |
| 15:00 |
00:15:00 |
Oral |
Lukasz Madej |
Comparison of the strain distribution obtained from multi scale and conventional approaches |
| 15:30 |
Coffee break |
| 15:50 |
Phase Transformations - Stefan Müller, Hualong Li, Paweł Dłużewski |
| 15:50 |
00:30:00 |
Invited oral |
Frederic Soisson |
Atomistic Monte Carlo simulations of phase transformations under irradiation |
| 16:20 |
00:30:00 |
Invited oral |
Cornelis Bos |
Multi-lattice kinetic Monte Carlo simulation of interface controlled solid-state transformations |
| 16:50 |
00:30:00 |
Invited oral |
Tetsuo Mohri |
First principles calculation of ordering transition |
| 17:20 |
Poster Session 1 - Main Hall |
| 17:20 |
#H-1 |
Poster |
Mikhail D. Starostenkov |
Point defects and their influence on thermoactivated disordering process of Ni3Al intermetallic |
| 17:20 |
#H-2 |
Poster |
Irina V. Valikova |
Atomic and meso-scale simulation of the diffusion features of point defects. |
| 17:20 |
#H-3 |
Poster |
Ludmila V. Selezneva |
Simulation of interstitial atom diffusion in fcc metals with point defects |
| 17:20 |
#H-4 |
Poster |
Jiri K. Bursik |
Monte Carlo and Molecular Dynamics Simulation of Ordering and its Effect on Elastic Parameters in Ni-base Alloys |
| 17:20 |
#H-5 |
Poster |
Graeme E. Murch |
Analysis of the time-dependence of the segregation of oxygen at metal-ceramic oxide interfaces using lattice Monte Carlo and finite element methods. |
| 17:20 |
#H-7 |
Poster |
Maciej M. Spychalski |
Materials hardness estimation by simulation of the indentation process |
| 17:20 |
#H-8 |
Poster |
Graeme E. Murch |
Stability of hollow nanospheres: a Molecular Dynamics study |
| 17:20 |
#H-9 |
Poster |
Marek Muzyk |
Thermal properties of L10-TiAl from first principle calculations |
| 17:20 |
#H-10 |
Poster |
Jacek Piechota |
First principles study of Al(100) twisted interfaces |
| 17:20 |
#H-11 |
Poster |
Robert Sot |
Predicting site occupation of Fe in B2 NiAl from ab initio computations |
| 17:20 |
#H-12 |
Poster |
Pawel S. Zieba |
Interface dynamics of melt instabilities on semiconductor surfaces |
| 17:20 |
#H-13 |
Poster |
Tomasz Wejrzanowski |
Grain Boundary Migration in Nanocrystalline Iron |
| 17:20 |
#H-14 |
Poster |
Mikhail D. Starostenkov |
The research of thermoactivated changes of the structure of antiphase boundaries in Cu3Au and Ni3Al alloys |
| 17:20 |
#H-15 |
Poster |
Rozaliya I. Barabash |
Multiscale Plastic Deformation Near Fatigue Crack From Diffraction |
| 17:20 |
#H-16 |
Poster |
Tomasz Wejrzanowski |
Statistical model of grain growth in polycrystalline nanomaterials |
September 5th, Tuesday |
|
| 09:00 |
Ordering Processes - Carlo Massobrio, Alain Barbu, Robert Sot |
| 09:00 |
00:30:00 |
Oral |
Christian Abromeit |
Molecular Dynamics Simulation of Swift-Ion-Induced Phase Transformations in a Model NiAl Alloy |
| 09:30 |
00:15:00 |
Oral |
Katri Laaksonen |
Multiscale simulation of ordering processes in GaInN and GaAlN |
| 09:45 |
00:15:00 |
Oral |
Rafal Kozubski |
Effect of Fe addition on ordering kinetics in Ni3Al1-xFex . Monte Carlo simulation |
| 10:30 |
Coffee break |
| 11:00 |
Precipitate Formation - Christian Abromeit, Simon P. Gill, Robert Filipek |
| 11:00 |
00:30:00 |
Invited oral |
Stefan Müller |
Ab-initio statistical physics of precipitate evolution in metal alloys |
| 11:30 |
00:30:00 |
Invited oral |
Alain Barbu |
Cluster dynamics modelling of materials : advantages and limitations. |
| 12:00 |
00:15:00 |
Oral |
Nuno Araújo |
Early stages of island nucleation and growth on Ag/Ag(100) |
| 12:15 |
00:15:00 |
Oral |
Byeong-Joo Lee |
An Atomistic Approach to the Effect of Cr on the Rate of Void Formation and Agglomeration in bcc Fe |
| 12:30 |
Lunch break |
| 14:00 |
Simulation of Defect Processes - Irina V. Belova, Jiri K. Bursik, Dariusz Chrobak |
| 14:30 |
00:15:00 |
Oral |
Véronique Pierron-Bohnes |
Interdiffusion of two L10 phases without order decrease : experiments and molecular dynamics simulations |
| 14:45 |
00:20:00 |
Oral |
Mihai-Cosmin Marinica |
Stability and mobility of interstitial clusters in alpha-iron: ab initio and empirical potential calculations |
| 15:00 |
00:15:00 |
Oral |
Mikhail D. Starostenkov |
The stability of vacancy clusters in fcc crystals |
| 15:15 |
00:15:00 |
Oral |
Guillaume Vérité |
Kinetics of point defects in hcp-Zr from first principles |
| 15:30 |
Coffee break |
| 15:50 |
Microstructure, Layers and Thin Films - Frederic Soisson, Cornelis Bos, Pawel S. Zieba |
| 15:50 |
00:15:00 |
Oral |
Sergey A. Lurie |
Multiscale modeling of the interphase layer and its applications in mechanics of materials |
| 16:05 |
00:15:00 |
Oral |
Witold Kucza |
Electrochemical impedance spectroscopy simulations of multilayer systems: from nano- to mesoscale films. |
| 16:20 |
00:15:00 |
Oral |
Hualong Li |
Monte Carlo Simulation of Texture and Microstructure Transformation During Annealing Process of Steel |
| 16:35 |
00:15:00 |
Oral |
Nele Moelans |
3-D phase field simulations of grain growth in polycrystalline films |
| 16:50 |
00:15:00 |
Oral |
Paweł Dłużewski |
FE and MD simulation of InGaN QD formation induced by stress field of threading dislocations |
| 17:05 |
00:15:00 |
Oral |
Shuo Wang YANG |
Why and how does hydrogen in silicon carbide thinfilms degrade the Ta barrier? - Large-scale ab initio molecular dynamics simulations of Ta growth |
September 6th, Wednesday |
|
| 09:30 |
Plenary Session - 2nd floor, Small Hall (237) |
| 10:30 |
Coffee break |
| 11:00 |
Plenary Session - 2nd floor, Small Hall (237) |
| 12:30 |
Lunch break |
| 14:00 |
Simulation of Nanostructures - Murray S. Daw, Sergey A. Lurie, Marek Muzyk |
| 14:00 |
00:30:00 |
Invited oral |
Carlo Massobrio |
Understanding materials at the atomic scale: first-principles molecular dynamics simulations of nanostructures and disordered systems |
| 14:30 |
00:15:00 |
Oral |
Zoltán Erdélyi |
Interface shape change and shift kinetics on the nanoscale |
| 14:45 |
00:15:00 |
Oral |
António Cadilhe |
Single layer colloidal films on nanopatterned substrates |
| 15:00 |
00:15:00 |
Oral |
Robert Filipek |
Multiscale modelling of mass and charge transport in electrochemical and biological systems |
| 15:30 |
Coffee break |
| 15:50 |
Poster Session 2 / Poster Award Ceremony - (continuation of Monday's Poster Session), Main Hall |
