Astaroth: Ohjelmistokirjasto stensiililaskentaan grafiikkasuorittimilla

Graphics processing units (GPUs) are coprocessors, which offer higher throughput and better power efficiency than central processing units in dataparallel tasks. For this reason, graphics processors provide a good platform for high-performance computing. However, programming GPUs such that all the available performance is utilized requires in-depth knowledge of the architecture of the hardware. Additionally, the problem of high-order stencil computations on GPUs in challenging multiphysics applications has not been adequately explored in previous work. In this thesis, we address these issues by presenting a library, an efficient algorithm and a domain-specific language for solving stencil computations within a structured grid. We tested our implementation by simulating magnetohydrodynamics, which involved the computation of first, second, and cross partial derivatives using second-, fourth-, sixth-, and eight-order finite differences with single and double precision. The running time of our integration kernel was 2.8–9.1 times slower than the theoretical minimum time, which it would take to read the computational domain and write it back to device memory exactly once, without taking into account the effects of finite caches or arithmetic operations on performance. Additionally, we made a performance comparison with a CPU solver widely used for scientific computations, which we benchmarked on a total of 24 cores of two Intel Xeon E5-2690 v3 processors. Our solver, benchmarked on a Tesla P100 PCIe GPU, outperformed the CPU solver by factors of 6.7 and 10.4 when using single and double precision, respectively.Grafiikkasuorittimet ovat apusuorittimia, jotka tarjoavat rinnakkain laskettavissa tehtävissä parempaa suoritus- ja energiatehokkuutta kuin keskussuorittimet. Tästä syystä grafiikkasuorittimet tarjoavat hyvän alustan suurteholaskennan tarpeisiin. Toisaalta grafiikkasuorittimen ohjelmointi siten, että kaikki tarjolla oleva suorituskyky saadaan hyödynnettyä, vaatii syvällistä asiantuntemusta ohjelmoitavan laitteiston arkkitehtuurista. Korkean asteen stensiililaskentaa haastavissa fysiikkasovelluksissa ei ole myöskään tutkittu laajalti aiemmissa julkaisuissa. Tässä työssä otamme kantaa näihin ongelmiin esittelemällä ohjelmistokirjaston, tehokkaan algoritmin, sekä tehtävään räätälöidyn ohjelmointikielen stensiililaskujen ratkaisemiseen säännöllisessä hilassa. Testasimme toteutustamme simuloimalla magnetohydrodynamiikkaa, johon kuului ensimmäisen ja toisen kertaluvun derivaattojen lisäksi ristiderivaattojen ratkaisutoisen, neljännen, kuudennen ja kahdeksannen kertaluvun differenssimenetelmällä käyttäen sekä 32- että 64-bittisiä liukulukuja. Integrointifunktiomme suoritusaika oli 2.8–9.1 kertaa hitaampi kuin teoreettinen vähimmäisajoaika, joka menisi laskennallisen alueen lukemiseen ja kirjoittamiseen apusuorittimen muistista täsmälleen kerran, ottamatta huomioon äärellisen välimuistin tai laskennan vaikutusta suoritusaikaan. Vertasimme kirjastomme suoritusaikaa laajalti tieteellisessä laskennassa käytettyyn keskussuorittimille tarkoitettuun ratkaisijaan, jonka ajoimme kokonaisuudessaan 24:llä ytimellä kahdella Intel Xeon E5-2690 v3 -suorittimella. Tähän ratkaisijaan verrattuna Tesla P100 PCIe -grafiikkasuorittimella ajettu ratkaisijamme oli 6.7 ja 10.4 kertaa nopeampi 32- ja 64-bittisillä liukuluvuilla laskettaessa, tässä järjestyksessä

MetaFork: A Compilation Framework for Concurrency Models Targeting Hardware Accelerators

Parallel programming is gaining ground in various domains due to the tremendous computational power that it brings; however, it also requires a substantial code crafting effort to achieve performance improvement. Unfortunately, in most cases, performance tuning has to be accomplished manually by programmers. We argue that automated tuning is necessary due to the combination of the following factors. First, code optimization is machine-dependent. That is, optimization preferred on one machine may be not suitable for another machine. Second, as the possible optimization search space increases, manually finding an optimized configuration is hard. Therefore, developing new compiler techniques for optimizing applications is of considerable interest. This thesis aims at generating new techniques that will help programmers develop efficient algorithms and code targeting hardware acceleration technologies, in a more effective manner. Our work is organized around a compilation framework, called MetaFork, for concurrency platforms and its application to automatic parallelization. MetaFork is a high-level programming language extending C/C++, which combines several models of concurrency including fork-join, SIMD and pipelining parallelism. MetaFork is also a compilation framework which aims at facilitating the design and implementation of concurrent programs through four key features which make MetaFork unique and novel: (1) Perform automatic code translation between concurrency platforms targeting multi-core architectures. (2) Provide a high-level language for expressing concurrency as in the fork-join model, the SIMD paradigm and the pipelining parallelism. (3) Generate parallel code from serial code with an emphasis on code depending on machine or program parameters (e.g. cache size, number of processors, number of threads per thread block). (4) Optimize code depending on parameters that are unknown at compile-time

Improving GPU Shared Memory Access Efficiency

Graphic Processing Units (GPUs) often employ shared memory to provide efficient storage for threads within a computational block. This shared memory includes multiple banks to improve performance by enabling concurrent accesses across the memory banks. Conflicts occur when multiple memory accesses attempt to simultaneously access a particular bank, resulting in serialized access and concomitant performance reduction. Identifying and eliminating these memory bank access conflicts becomes critical for achieving high performance on GPUs; however, for common 1D and 2D access patterns, understanding the potential bank conflicts can prove difficult. Current GPUs support memory bank accesses with configurable bit-widths; optimizing these bitwidths could result in data layouts with fewer conflicts and better performance. This dissertation presents a framework for bank conflict analysis and automatic optimization. Given static access pattern information for a kernel, this tool analyzes the conflict number of each pattern, and then searches for an optimized solution for all shared memory buffers. This data layout solution is based on parameters for inter-padding, intrapadding, and the bank access bit-width. The experimental results show that static bank conflict analysis is a practical solution and independent of the workload size of a given access pattern. For 13 kernels from 6 benchmarks suites (RODINIA and NVIDIA CUDA SDK) facing shared memory bank conflicts, tests indicated this approach can gain 5%- 35% improvement in runtime

Evaluation of Distributed Programming Models and Extensions to Task-based Runtime Systems

High Performance Computing (HPC) has always been a key foundation for scientific simulation and discovery. And more recently, deep learning models\u27 training have further accelerated the demand of computational power and lower precision arithmetic. In this era following the end of Dennard\u27s Scaling and when Moore\u27s Law seemingly still holds true to a lesser extent, it is not a coincidence that HPC systems are equipped with multi-cores CPUs and a variety of hardware accelerators that are all massively parallel. Coupling this with interconnect networks\u27 speed improvements lagging behind those of computational power increases, the current state of HPC systems is heterogeneous and extremely complex. This was heralded as a great challenge to the software stacks and their ability to extract performance from these systems, but also as a great opportunity to innovate at the programming model level to explore the different approaches and propose new solutions. With usability, portability, and performance as the main factors to consider, this dissertation first evaluates some of the widely used parallel programming models (MPI, MPI+OpenMP, and task-based runtime systems) ability to manage the load imbalance among the processes computing the LU factorization of a large dense matrix stored in the Block Low-Rank (BLR) format. Next I proposed a number of optimizations and implemented them in PaRSEC\u27s Dynamic Task Discovery (DTD) model, including user-level graph trimming and direct Application Programming Interface (API) calls to perform data broadcast operation to further extend the limit of STF model. On the other hand, the Parameterized Task Graph (PTG) approach in PaRSEC is the most scalable approach for many different applications, which I then explored the possibility of combining both the algorithmic approach of Communication-Avoiding (CA) and the communication-computation overlapping benefits provided by runtime systems using 2D five-point stencil as the test case. This broad programming models evaluation and extension work highlighted the abilities of task-based runtime system in achieving scalable performance and portability on contemporary heterogeneous HPC systems. Finally, I summarized the profiling capability of PaRSEC runtime system, and demonstrated with a use case its important role in the performance bottleneck identification leading to optimizations

The Investigation of Efficiency of Physical Phenomena Modelling Using Differential Equations on Distributed Systems

This work is dedicated to development of mathematical modelling software. In this dissertation numerical methods and algorithms are investigated in software making context. While applying a numerical method it is important to take into account the limited computer resources, the architecture of these resources and how do methods affect software robustness. Three main aspects of this investigation are that software implementation must be efficient, robust and be able to utilize specific hardware resources. The hardware specificity in this work is related to distributed computations of different types: single CPU with multiple cores, multiple CPUs with multiple cores and highly parallel multithreaded GPU device. The investigation is done in three directions: GPU usage for 3D FDTD calculations, FVM method usage to implement efficient calculations of a very specific heat transferring problem, and development of special techniques for software for specific bacteria self organization problem when the results are sensitive to numerical methods, initial data and even computer round-off errors. All these directions are dedicated to create correct technological components that make a software implementation robust and efficient. The time prediction model for 3D FDTD calculations is proposed, which lets to evaluate the efficiency of different GPUs. A reasonable speedup with GPU comparing to CPU is obtained. For FVM implementation the OpenFOAM open source software is selected as a basis for implementation of calculations and a few algorithms and their modifications to solve efficiency issues are proposed. The FVM parallel solver is implemented and analyzed, it is adapted to heterogeneous cluster Vilkas. To create robust software for simulation of bacteria self organization mathematically robust methods are applied and results are analyzed, the algorithm is modified for parallel computations

Software for Exascale Computing - SPPEXA 2016-2019

This open access book summarizes the research done and results obtained in the second funding phase of the Priority Program 1648 "Software for Exascale Computing" (SPPEXA) of the German Research Foundation (DFG) presented at the SPPEXA Symposium in Dresden during October 21-23, 2019. In that respect, it both represents a continuation of Vol. 113 in Springer’s series Lecture Notes in Computational Science and Engineering, the corresponding report of SPPEXA’s first funding phase, and provides an overview of SPPEXA’s contributions towards exascale computing in today's sumpercomputer technology. The individual chapters address one or more of the research directions (1) computational algorithms, (2) system software, (3) application software, (4) data management and exploration, (5) programming, and (6) software tools. The book has an interdisciplinary appeal: scholars from computational sub-fields in computer science, mathematics, physics, or engineering will find it of particular interest

Proceedings of the First International Workshop on Sustainable Ultrascale Computing Systems (NESUS 2014): Porto, Portugal

Proceedings of: First International Workshop on Sustainable Ultrascale Computing Systems (NESUS 2014). Porto (Portugal), August 27-28, 2014

High-Performance Modelling and Simulation for Big Data Applications

This open access book was prepared as a Final Publication of the COST Action IC1406 “High-Performance Modelling and Simulation for Big Data Applications (cHiPSet)“ project. Long considered important pillars of the scientific method, Modelling and Simulation have evolved from traditional discrete numerical methods to complex data-intensive continuous analytical optimisations. Resolution, scale, and accuracy have become essential to predict and analyse natural and complex systems in science and engineering. When their level of abstraction raises to have a better discernment of the domain at hand, their representation gets increasingly demanding for computational and data resources. On the other hand, High Performance Computing typically entails the effective use of parallel and distributed processing units coupled with efficient storage, communication and visualisation systems to underpin complex data-intensive applications in distinct scientific and technical domains. It is then arguably required to have a seamless interaction of High Performance Computing with Modelling and Simulation in order to store, compute, analyse, and visualise large data sets in science and engineering. Funded by the European Commission, cHiPSet has provided a dynamic trans-European forum for their members and distinguished guests to openly discuss novel perspectives and topics of interests for these two communities. This cHiPSet compendium presents a set of selected case studies related to healthcare, biological data, computational advertising, multimedia, finance, bioinformatics, and telecommunications

High-Performance Modelling and Simulation for Big Data Applications

This open access book was prepared as a Final Publication of the COST Action IC1406 “High-Performance Modelling and Simulation for Big Data Applications (cHiPSet)“ project. Long considered important pillars of the scientific method, Modelling and Simulation have evolved from traditional discrete numerical methods to complex data-intensive continuous analytical optimisations. Resolution, scale, and accuracy have become essential to predict and analyse natural and complex systems in science and engineering. When their level of abstraction raises to have a better discernment of the domain at hand, their representation gets increasingly demanding for computational and data resources. On the other hand, High Performance Computing typically entails the effective use of parallel and distributed processing units coupled with efficient storage, communication and visualisation systems to underpin complex data-intensive applications in distinct scientific and technical domains. It is then arguably required to have a seamless interaction of High Performance Computing with Modelling and Simulation in order to store, compute, analyse, and visualise large data sets in science and engineering. Funded by the European Commission, cHiPSet has provided a dynamic trans-European forum for their members and distinguished guests to openly discuss novel perspectives and topics of interests for these two communities. This cHiPSet compendium presents a set of selected case studies related to healthcare, biological data, computational advertising, multimedia, finance, bioinformatics, and telecommunications

Proceedings, MSVSCC 2018

Proceedings of the 12th Annual Modeling, Simulation & Visualization Student Capstone Conference held on April 19, 2018 at VMASC in Suffolk, Virginia. 155 pp