Software Downloads
A Practical Guide to Monte Carlo Simulations and Classical Molecular Dynamics Simulations -An Example Book-
Nova Science Publishers, textbook, (2006)
ISBN: 1-59454-531-6
U. Burghaus (Dept.of Chemistry, North Dakota State University)
J. Stephan ( Fraunhofer Microelectronics Alliance, Berlin, Germany)
L. Vattuone( Struttura della Materia at the Universityof Genova, Italy)
J.M. Rogowska ( Institute of Experimental Physics,University of Wroc?aw, Poland )
Novapublishers Website
Direct link to book
| Program source code available here (ASCII 180k) | ||||
| Windows Version | setup.exe | MCS.001 | MCS.002 | (MCS) |
| setup2.exe | KMCS.001 | KMCS.002 | (KMCS) | |
| setup3.exe | FR.001 | FR.002 | (KMCS Fractals) | |
| Powerpoint | in preperation | |||
Kinetic Monte Carlo Simulations of thermal desorption spectrosccopy data: KMCS-TDS
by (C) E. Kadossov, 2009
Program source code available here
Related Paper:
Multi-site kinetic monte carlo simulations of thermal desorption spectroscopy data,
Surface Science 603 (2009) 2494-2501
by E. Kadossov, U. Burghaus
CHEM 796
For your homework projects: software tools, example data files, etc..
Langmuir-Hinshelwood kinetics of CO oxidation reaction
setup.exe LH.001 LH.002
Thermal desorption spectroscopy (TDS)
Analytical integration of the Polanyi-Wigner Eq.
setup.exe PW.001 PW.002
see also http://chemmac1.usc.edu/tpd1.php
TDS example data files
group1 group2 group3
CHEM 472 / 672
- Distance Education Class -