rDLB: A Novel Approach for Robust Dynamic Load Balancing of Scientific Applications with Parallel Independent Tasks

Scientific applications often contain large and computationally intensive parallel loops. Dynamic loop self scheduling (DLS) is used to achieve a balanced load execution of such applications on high performance computing (HPC) systems. Large HPC systems are vulnerable to processors or node failures and perturbations in the availability of resources. Most self-scheduling approaches do not consider fault-tolerant scheduling or depend on failure or perturbation detection and react by rescheduling failed tasks. In this work, a robust dynamic load balancing (rDLB) approach is proposed for the robust self scheduling of independent tasks. The proposed approach is proactive and does not depend on failure or perturbation detection. The theoretical analysis of the proposed approach shows that it is linearly scalable and its cost decrease quadratically by increasing the system size. rDLB is integrated into an MPI DLS library to evaluate its performance experimentally with two computationally intensive scientific applications. Results show that rDLB enables the tolerance of up to (P minus one) processor failures, where P is the number of processors executing an application. In the presence of perturbations, rDLB boosted the robustness of DLS techniques up to 30 times and decreased application execution time up to 7 times compared to their counterparts without rDLB

SPH-EXA: Enhancing the Scalability of SPH codes Via an Exascale-Ready SPH Mini-App

Numerical simulations of fluids in astrophysics and computational fluid dynamics (CFD) are among the most computationally-demanding calculations, in terms of sustained floating-point operations per second, or FLOP/s. It is expected that these numerical simulations will significantly benefit from the future Exascale computing infrastructures, that will perform 10^18 FLOP/s. The performance of the SPH codes is, in general, adversely impacted by several factors, such as multiple time-stepping, long-range interactions, and/or boundary conditions. In this work an extensive study of three SPH implementations SPHYNX, ChaNGa, and XXX is performed, to gain insights and to expose any limitations and characteristics of the codes. These codes are the starting point of an interdisciplinary co-design project, SPH-EXA, for the development of an Exascale-ready SPH mini-app. We implemented a rotating square patch as a joint test simulation for the three SPH codes and analyzed their performance on a modern HPC system, Piz Daint. The performance profiling and scalability analysis conducted on the three parent codes allowed to expose their performance issues, such as load imbalance, both in MPI and OpenMP. Two-level load balancing has been successfully applied to SPHYNX to overcome its load imbalance. The performance analysis shapes and drives the design of the SPH-EXA mini-app towards the use of efficient parallelization methods, fault-tolerance mechanisms, and load balancing approaches.Comment: arXiv admin note: substantial text overlap with arXiv:1809.0801

Enhancing Energy Production with Exascale HPC Methods

High Performance Computing (HPC) resources have become the key actor for achieving more ambitious challenges in many disciplines. In this step beyond, an explosion on the available parallelism and the use of special purpose processors are crucial. With such a goal, the HPC4E project applies new exascale HPC techniques to energy industry simulations, customizing them if necessary, and going beyond the state-of-the-art in the required HPC exascale simulations for different energy sources. In this paper, a general overview of these methods is presented as well as some specific preliminary results.The research leading to these results has received funding from the European Union's Horizon 2020 Programme (2014-2020) under the HPC4E Project (www.hpc4e.eu), grant agreement n° 689772, the Spanish Ministry of Economy and Competitiveness under the CODEC2 project (TIN2015-63562-R), and from the Brazilian Ministry of Science, Technology and Innovation through Rede Nacional de Pesquisa (RNP). Computer time on Endeavour cluster is provided by the Intel Corporation, which enabled us to obtain the presented experimental results in uncertainty quantification in seismic imagingPostprint (author's final draft

Optimizing Collective Communication for Scalable Scientific Computing and Deep Learning

In the realm of distributed computing, collective operations involve coordinated communication and synchronization among multiple processing units, enabling efficient data exchange and collaboration. Scientific applications, such as simulations, computational fluid dynamics, and scalable deep learning, require complex computations that can be parallelized across multiple nodes in a distributed system. These applications often involve data-dependent communication patterns, where collective operations are critical for achieving high performance in data exchange. Optimizing collective operations for scientific applications and deep learning involves improving the algorithms, communication patterns, and data distribution strategies to minimize communication overhead and maximize computational efficiency. Within the context of this dissertation, the specific focus is on optimizing the alltoall operation in 3D Fast Fourier Transform (FFT) applications and the allreduce operation in parallel deep learning, particularly on High-Performance Computing (HPC) systems. Advanced communication algorithms and methods are explored and implemented to improve communication efficiency, consequently enhancing the overall performance of 3D FFT applications. Furthermore, this dissertation investigates the identification of performance bottlenecks during collective communication over Horovod on distributed systems. These bottlenecks are addressed by proposing an optimized parallel communication pattern specifically tailored to alleviate the aforementioned limitations during the training phase in distributed deep learning. The objective is to achieve faster convergence and improve the overall training efficiency. Moreover, this dissertation proposes fault tolerance and elastic scaling features for distributed deep learning by leveraging the User-Level Failure Mitigation (ULFM) from Message Passing Interface (MPI). By incorporating ULFM MPI, the dissertation aims to enhance the elastic capabilities of distributed deep learning systems. This approach enables graceful and lightweight handling of failures while facilitating seamless scaling in dynamic computing environments

Extending the OpenCHK Model with Advanced Checkpoint Features

One of the major challenges in using extreme scale systems efficiently is to mitigate the impact of faults. Application-level checkpoint/restart (CR) methods provide the best trade-off between productivity, robustness, and performance. There are many solutions implementing CR at the application level. They all provide advanced I/O capabilities to minimize the overhead introduced by CR. Nevertheless, there is still room for improvement in terms of programmability and flexibility, because end-users must manually serialize and deserialize application state using low-level APIs, modify the flow of the application to consider restarts, or rewrite CR code whenever the backend library changes. In this work, we propose a set of compiler directives and clauses that allow users to specify CR operations in a simple way. Our approach supports the common CR features provided by all the CR libraries. However, it can also be extended to support advanced features that are only available in some CR libraries, such as differential checkpointing, the use of HDF5 format, and the possibility of using fault-tolerance-dedicated threads. The result of our evaluation revealed a high increase in programmability. On average, we reduced the number of lines of code by 71%, 94%, and 64% for FTI, SCR, and VeloC, respectively, and no additional overhead was perceived using our solution compared to using the backend libraries directly. Finally, portability is enhanced because our programming model allows the use of any backend library without changing any code