Fujitsu Materials Explorer V4.0

Materials Explorer aids your research in: Organics, polymers, biomolecules, metals, ceramics, semiconductors, etc. Crystals, amorphous solids, liquids and gases (periodic boundaries) Phase transitions, expansion, compressibility, tensile strength, defects, etc. Easy to use Point-and-click operation and an intuitive graphical interface make it simple to build assemblies of molecules in a cell, to set up the calculations, and to interpret the results.Full MD Engine IncludedTemperature and pressure-controlled MD simulations are available by employing the Parrinello-Rahman and Nose methods. A velocity-scaling method is also available for controlled temperatures. Both the SHAKE algorithm and the rigid-body treatment can also be applied to molecular systems.Ready for Large SystemsMaterials Explorer for Windows can easily interface with vector- and SPP-type UNIX-machines to run high performance calculations for very large systems. Highly vectorized and parallelized MD module options are available for such applications.
product:Fujitsu Materials Explorer V4.0
Lanaguage:english
Platform:Winxp/Win7
Size:128MB