Since October 2005, I'm leading the development of CMSapi and CMPTool. CMSapi is a library implementing a large numer of algorithms and methods currently used in classical and tight binding simulations. CMPTool, which is based on CMPTool, is a classical and thight binding molecular dynamics (MD) code (see CMSapi and CMPTool home pages for further informations). In my spare time, I also develop and maintain MoDERN, a very simple F90 MD code that I use for my lectures on MD and serial and parallel programming. You can download MoDERN (OpenMP version, only Lennard-Jones potential) or MoDERN_serial (new version, 1.0 (Feb. 17, 2009), containing new features - Nose'-Hoover - and new analysis tools - properties depending on fluctuations). If you are interested in Montecarlo simulations, you might want to try MoCa (serial version of atomistic Metropolis Montecarlo, Lennard-Jones and Stillinger-Weber potentials).
In addition, once again for supporting my lectures, once again in my spare time!, I develop a parallel Laplace solver (click here to download). Finally, I promote adoption of CP2K and I intend to use this software for my research in the future (in the coming months, we shall try to transfer our components into CP2K).
