These lecture notes were used in a
Research School about Multiscale Materials Modelling.
August 25th to 31st , 2001
( University of Sidi-Bel-Abbes, 22000, Algeria )
-
Introduction of Tokyo Institute of Technology.
- Location
- Education system
- Number of academic staff
- Number of students
- Expenditure
- Foreign students
- Scholarship
-
History of EAM series; evolution of EAM theory.
- Quantum calculation to EAM
- History of EAM series
- EAM84
- Superimposition of atomic electron density
- EAM86
- MEAM92
- Embedding function
- s,p,d,f symmetry in MEAM
- Applicability
- LJ-EAM
- Let's make an original EAM ;
DR-EAM and its results.
- Idea of Dimer Reference EAM
- Phase diagram
- Philosophy
- Farther possibility
-
Computer exercise by using a
program by Takahashi.
- Total energy calculation
- Enegetics for uniform dilation
- Reconstruction calculation
- Deformation of C60
- Let's
visualize the calculated results by using
AView.
- Down load
- Data file format
- Exprot file format
- Three windows
- Mouse & wheel stirring
Lectures in the summer school
Research School about Multiscale Materials Modelling.
August 25th to 31st , 2001
( University of Sidi-Bel-Abbes, 22000, Algeria )
organized by prof.Hafid Aourag
- Classical MD - Simulations on Massively Parallel Supercomputers with Application to Shock Waves in Solids.
- Johannes ROTH,
Institut fur Theoretische und Angewandte Physik
Universitat Stuttgart, Pfaffenwaldring 57, Room 6.150, GERMANY
- Theory and procedures of embedded atom method (EAM) series ; the method to calculate energy of multi-atomic systems
- Kunio TAKAHASHI,
Tokyo Institute of Technology, Tokyo 152-8552, JAPAN
- Potentials functions
- Sakir ERKOC,
Middle East Technical University,
Department of Physics, 06531 Ankara, TURKEY
- Hartree-Fock and Crystal
- Sylvia CASSASA,
University of Torino, ITALY
- Classical Molecular Dynamics
- Ahmed Lazreg,
University of Sidi Belabbes, Algeria
- Ab initio Pseudopotential Calculations
- Bachir Bouhafs,
University of Sidi Bel-abbes, Algeria
Abbar Boucif,
University of Sidi Bel-abbes, Algeria
- Tight Binding Total Energy,
- Amel Laref,
University of Sidi Bel-abbes, Algeria
- Finite Element Method
- Goumri-Said Souraya,
University of Sidi-Bel-Abbes, Algeria
- MultiScale Materials Modelling
- Hafid Aourag,
University of Sidi Bel-abbes, Algeria