Publications and other Achievements
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Publications[1] A. KOHLMEYER, W. WITSCHEL, E. SPOHR.Molecular dynamics simulations of water/metal and water/vacuum interfaces with a polarizable water model. Chem. Phys., 213, 211-216, (1996). PDF version (english)
[2] A. KOHLMEYER, W. WITSCHEL, E. SPOHR.
[3] A. KOHLMEYER, C. HARTNIG, E. SPOHR.
[4] P. A. BOPP, A. KOHLMEYER, E. SPOHR.
[5] E. SCHREINER, CH. NICOLINI, B. LUDOLPH, R. RAVINDRA,
[6] R. ROUSSEAU, E. SCHREINER, A. KOHLMEYER, D. MARX
[7] S.D. SENANAYAKE, A. SOON, A. KOHLMEYER, T. SÖHNEL, H. IDRISS
[8] M. BAER, E. SCHREINER, A. KOHLMEYER, R. ROUSSEAU, D. MARX
[9] S. COZZINI, A. KOHLMEYER, R. ROUSSEAU
[A] Diplom thesis: Computersimulationen von Wasserensembles unter Berücksichtigung der Polarisierbarkeit PDF version (german)
[B] PhD thesis: Invited Talks / Workshops- ICTP/Democritos Joint Workshop on Tools for Computational Physics- The KISS Approach to Linux Clustering and other lectures on High-Performance Computing as part of the ICTP School on Linux Clusters for High Performance Computing (PDF) at KNUST, Kumasi and at the Ghana-India Kofi Annan Centre of Excellence in ICT, Accra in Ghana, January 17-28th, 2005. - Preparation and Presentation of the Practical Exercises as part of a CPMD for biological problems tutorial: Aplicaciones de la dinámica molecular de Car-Parrinello al estudio de problemas biológicos Barcelona, Spain, November 23-26th, 2004.
- High-Performance Computing in Theoretical Chemistry: Today and Tomorrow
- Applications and Limitations of Molecular Dynamics
Simulations of Aqueous Systems
- 32-bit vs. 64-bit CPUs in Scientific Computing
- Effects of System Size and Time Scales in Molecular Dynamics
Simulations of Bulk Water
- Bochum Linux Blues AwardsWolfgang Hande Preis for e-Learning 2001 (together with Dr. Karin Fink) for the concept and design of the lab-courses in theoretical chemistry and biochemistry in Bochum.- Press release of the Ruhr-Uni Bochum (german). - Article in university newspaper 'Rubens' (german) PDF version (german) Notable EventsFall 2002:The largest in-house compute resource of the Lehrstuhl für Theoretische Chemie, a 76-node dual AMD-Athlon Cluster with a SCI 2D-torus high-speed interconnect, enters the Top500 list of the fastest supercomputers worldwide with a ranking of 302 using the largest availble network of 64-nodes. - Press release of the Ruhr-Uni Bochum (german). - Article in regional newspaper Westdeutsche Allgemeine Zeitung (WAZ) PDF version (german) - Article in university newspaper add-on RUBbits (german) PDF version (german) - Article in Heise News-Ticker (german) - Benchmark results (High-Performance Linpack), that led to the Top500 ranking: |
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Disclaimer / Author of this page: Axel.Kohlmeyer@theochem.ruhr-uni-bochum.de Source File: publications.wml (Sun Oct 9 22:49:27 2005) ($Revision: 1.22 $) Translated to HTML: Mon Oct 10 00:07:26 2005 |