Time
|
Duration
|
Type
|
Presenting person
|
Title
|
September 6th, Monday |
|
| 14:00 |
00:30:00 |
invited oral |
GEORGE D. VERROS |
Finite Element Analysis of Diffusion Controlled Phase Transformation |
| 14:30 |
00:15:00 |
oral |
Stefano Mariani |
Time multiscale analysis of dynamic delamination |
| 14:45 |
00:15:00 |
oral |
Varvara A. Romanova |
3D simulation of deformation and fracture in heterogeneous materials |
| 15:00 |
00:15:00 |
oral |
Pravin P. Deshpande |
A numerical investigation of ductile fracture initiation in ultra high strength low alloy NiSiCrCoMo steel |
| 15:50 |
00:30:00 |
invited oral |
Jan Cwajna |
COMPUTATIONAL IMAGE ANALYSIS OF MATERIALS MICROSTRUCTURE |
| 16:20 |
00:30:00 |
invited oral |
Leszek Wojnar |
3-D image analysis in materials science |
| 16:50 |
00:15:00 |
oral |
Elzbieta Kaczmarek |
Digital image analysis and visualization of early caries changes in human teeth |
| 17:05 |
00:15:00 |
oral |
Henryk Petryk |
A micromechanical model of stress-induced martensitic transformations in shape memory alloys |
| 17:20 |
00:15:00 |
oral |
Roman Pielaszek |
Measuring the Grain Size Distribution of Pr-doped Zirconia Nanopowders obtained by Microwave Driven Hydrothermal Synthesis |
September 7th, Tuesday |
|
| 11:00 |
00:30:00 |
invited oral |
Chris Wolverton |
The Role of Quantum Mechanics in Virtual Aluminum Castings |
| 11:30 |
00:30:00 |
invited oral |
Wojciech Grochala |
Superconductivity and the grand periodic table of the chemical elements |
| 12:00 |
00:15:00 |
oral |
Helmut Hermann |
Influence of the packing effect on stability and transformation of nanoparticles embedded in random matrices |
| 12:15 |
00:15:00 |
oral |
Rafal Kozubski |
ATOMISTIC MODELLING OF SUPERSTRUCTURE REFINEMENT IN CRYSTALLINE MATERIALS |
| 14:00 |
00:30:00 |
invited oral |
Dieter Wolf |
Deformation Mechanisms in Nanocrystalline Materials by Molecular-Dynamics Simulation |
| 14:30 |
00:30:00 |
invited oral |
László Gránásy |
Nucleation and polycrystalline growth in phase field theory |
| 15:00 |
00:15:00 |
oral |
MICHA POLAK |
Computational prediction of compositional separation, ordering and heat-capacity effects in surface-segregated binary & ternary alloy nanoclusters |
| 15:15 |
00:15:00 |
oral |
Mikhail D. Starostenkov |
DIFFUSION MECHANISM AT THE GRAIN BOUNDARIES IN TWO-DIMENSIONAL METALS |
| 15:30 |
00:15:00 |
oral |
Wlodzimierz KLONOWSKI |
Fractal and Symbolic Methods for Nanomaterials Science and Nanosensors |
September 8th, Wednesday |
|
| 09:00 |
00:30:00 |
invited oral |
Raimund Podloucky |
Materials properties from ab initio approaches |
| 09:30 |
00:30:00 |
invited oral |
Stefan Müller |
Ab-initio thermodynamics of metal alloys: From the atomic to the mesoscopic scale |
| 10:00 |
00:15:00 |
oral |
Sergiy G. Nedilko |
Modelling and ab initio calculation of electronic structure of lead and cadmium tungstate crystals doped with the rare-earth ions |
| 11:00 |
00:30:00 |
invited oral |
Krzysztof Parlinski |
Vibrational and thermodynamical properties of solids |
| 11:30 |
00:30:00 |
invited oral |
Carlo Massobrio |
Atomic structure and intermediate range order in network-forming disordered materials |
| 12:00 |
00:15:00 |
oral |
Nevill Gonzalez Szwacki |
Structural properties of MnTe, ZnTe, and ZnO, and phase stability of Mn_xZn_{1-x}Te alloy |
| 12:15 |
00:15:00 |
oral |
Pedro García-Mochales |
Atomic Configuration of Nanocontact: Ionic Shell and Sub-shell Structures |
| 14:00 |
00:30:00 |
invited oral |
Walter Wolf |
Vibrational properties and thermochemistry from first principles |
| 14:30 |
00:30:00 |
invited oral |
Masanori Kohno |
Magnetic and Electronic Properties of new Ferrimagnet Sr_8CaRe_3Cu_4O_{24} |
| 15:00 |
00:15:00 |
oral |
Jacek Piechota |
Phase transition in the Nd-Fe-B system |
| 15:15 |
00:30:00 |
invited oral |
Berit Hinnemann |
Surface and biological catalysts for ammonia synthesis and hydrogen evolution |
September 9th, Thursday |
|
| 09:00 |
00:30:00 |
invited oral |
Mike W. Finnis |
The Embrittlement of Cu by Bi: explanation based on first-principles calculations |
| 09:30 |
00:30:00 |
invited oral |
Jun Nara |
Theoretical study on electron transport properties of an organic molecule |
| 10:00 |
00:15:00 |
oral |
Minoru Ikeda |
First principles molecular dynamics simulations for amorphous HfO_2 and HfSiO_2 |
| 10:15 |
00:15:00 |
oral |
Ryszard B. Pecherski |
Ab Initio Calculations of the Critical Values of Elastic Energy Density |
| 11:00 |
00:30:00 |
invited oral |
Adam Kiejna |
Density-functional study of oxygen adsorption on Mo(112) |
| 11:30 |
00:30:00 |
invited oral |
Pablo Ordejon |
Using local orbitals to compute dynamical properties of materials |
| 12:00 |
00:15:00 |
oral |
Ole Wieckhorst |
Surface phase diagram of CoAl(100) |
| 12:15 |
00:15:00 |
oral |
Maria E. Grillo |
Combined Surface Science and Density Functional Theory Approach towards Water Ordered Structures Formation on Magnetite |
| 14:00 |
00:30:00 |
invited oral |
Roman Nowak |
PLASTIC PROPERTIES OF GaN AND Al_2O_3 CRYSTAL: FEM-SIMULATION OF NANOINDENTATION CONFIRMED BY HIGH-RESOLUTION MICROSCOPY |
| 14:30 |
00:15:00 |
oral |
Petr Lazar |
Ab-initio calculation of the influence Cr-microalloying on the mechanical properties of NiAl |
| 14:45 |
00:15:00 |
oral |
Hilmi Unlu |
COMPOSITION AND PRESSURE EFFECTS ON BANDGAPS AND BAND OFFSETS IN II-VI HETEROSTRUCTURES |
| 15:00 |
00:15:00 |
oral |
Elwira Wachowicz |
A DFT study of the oxidation of the
clean and hydrogenated Si-rich SiC surface |
