Building VASP* with Intel® MKL , Intel® Compilers and Intel® MPI
Step 1 – Overview
Why it is needed?
Are you working with a hybrid program that just isn't performing? Do you feel like your application is on life support?
The Intel® MPI Library and OpenMP* runtime libraries can create affinities between processes or threads, and hardware resources. This affinity keeps an MPI process or OpenMP thread from migrating to a different hardware resource, which can have a dramatic effect on the execution speed of a program.
There are two principal methods of parallel computing: distributed memory computing and shared memory computing. As more processor cores are dedicated to large clusters solving scientific and engineering problems, hybrid programming techniques combining the best of distributed and shared memory programs are becoming more popular.
Intel® Parallel Studio XE is a very popular product from Intel that includes the Intel® Compilers, Intel® Performance Libraries, tools for analysis, debugging and tuning, tools for MPI and the Intel® MPI Library. Did you know that some of these are available for free? Here is a guide to “what is available free” from the Intel Parallel Studio XE suites.
In this article an OpenMP* based implementation of the Ant Colony Optimization algorithm was analyzed for bottlenecks with Intel® VTune™ Amplifier XE 2016 together with improvements using hybrid MPI-OpenMP and Intel® Threading Building Blocks were introduced to achieve efficient scaling across a four-socket Intel® Xeon® processor E7-8890 v4 processor-based system.