Enhancing Monte Carlo Particle Transport for Modern Many-Core Architectures

Since near the very beginning of electronic computing, Monte Carlo particle transport has been a fundamental approach for solving computational physics problems. Due to the high computational demands and inherently parallel nature of these applications, Monte Carlo transport applications are often performed in the supercomputing environment. That said, supercomputers are changing, as parallelism has dramatically increased with each supercomputer node, including regular inclusion of many-core devices. Monte Carlo transport, like all applications that run on supercomputers, will be forced to make significant changes to their designs in order to utilize these new architectures effectively. This dissertation presents solutions for central challenges that face Monte Carlo particle transport in this changing environment, specifically in the areas of threading models, tracking algorithms, tally data collection, and heterogenous load balancing. In addition, the dissertation culminates with a study that combines all of the presented techniques in a production application at scale on Lawrence Livermore National Laboratory's RZAnsel Supercomputer

Advances in Molecular Simulation

Molecular simulations are commonly used in physics, chemistry, biology, material science, engineering, and even medicine. This book provides a wide range of molecular simulation methods and their applications in various fields. It reflects the power of molecular simulation as an effective research tool. We hope that the presented results can provide an impetus for further fruitful studies

Fundamentals

Volume 1 establishes the foundations of this new field. It goes through all the steps from data collection, their summary and clustering, to different aspects of resource-aware learning, i.e., hardware, memory, energy, and communication awareness. Machine learning methods are inspected with respect to resource requirements and how to enhance scalability on diverse computing architectures ranging from embedded systems to large computing clusters

Fundamentals

Volume 1 establishes the foundations of this new field. It goes through all the steps from data collection, their summary and clustering, to different aspects of resource-aware learning, i.e., hardware, memory, energy, and communication awareness. Machine learning methods are inspected with respect to resource requirements and how to enhance scalability on diverse computing architectures ranging from embedded systems to large computing clusters

Particle Physics Reference Library

This second open access volume of the handbook series deals with detectors, large experimental facilities and data handling, both for accelerator and non-accelerator based experiments. It also covers applications in medicine and life sciences. A joint CERN-Springer initiative, the “Particle Physics Reference Library” provides revised and updated contributions based on previously published material in the well-known Landolt-Boernstein series on particle physics, accelerators and detectors (volumes 21A,B1,B2,C), which took stock of the field approximately one decade ago. Central to this new initiative is publication under full open access

Competing Energy Lookup Algorithms in Monte Carlo Neutron Transport Calculations and Their Optimization on CPU and Intel MIC Architectures

AbstractThe Monte Carlo method is a common and accurate way to model neutron transport with minimal approximations. However, such method is rather time-consuming due to its slow convergence rate. More specifically, the energy lookup process for cross sections can take up to 80% of overall computing time and therefore becomes an important performance hotspot. Several optimization solutions have been already proposed: unionized grid, hashing and fractional cascading methods. In this paper we revisit those algorithms for both CPU and manycore (Intel MIC) architectures and introduce vectorized versions. Tests are performed with the PATMOS Monte Carlo prototype, and algorithms are evaluated and compared in terms of time performance and memory usage. Results show that significant speedup can be achieved over the conventional binary search on both CPU and Intel MIC. Further optimization with vectorization instructions has been proved very efficient on Intel MIC architecture due to its 512-bit Vector Processing Unit (VPU); on CPU this improvement is limited by the smaller VPU width