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Our goal is compression of massive-scale grid-structured data, such as the multi-terabyte output of a high-fidelity computational simulation. For such data sets, we have developed a new software package called TuckerMPI, a parallel C++/MPI software package for compressing distributed data. The approach is based on treating the data as a tensor, i.e., a multidimensional array, and computing its truncated Tucker decomposition, a higher-order analogue to the truncated singular value decomposition of a matrix. The result is a low-rank approximation of the original tensor-structured data. Compression efficiency is achieved by detecting latent global structure within the data, which we contrast to most compression methods that are focused on local structure. In this work, we describe TuckerMPI, our implementation of the truncated Tucker decomposition, including details of the data distribution and in-memory layouts, the parallel and serial implementations of the key kernels, and analysis of the storage, communication, and computational costs. We test the software on 4.5 terabyte and 6.7 terabyte data sets distributed across 100s of nodes (1000s of MPI processes), achieving compression rates between 100-200,000$times$ which equates to 99-99.999% compression (depending on the desired accuracy) in substantially less time than it would take to even read the same dataset from a parallel filesystem. Moreover, we show that our method also allows for reconstruction of partial or down-sampled data on a single node, without a parallel computer so long as the reconstructed portion is small enough to fit on a single machine, e.g., in the instance of reconstructing/visualizing a single down-sampled time step or computing summary statistics.
As parallel computing trends towards the exascale, scientific data produced by high-fidelity simulations are growing increasingly massive. For instance, a simulation on a three-dimensional spatial grid with 512 points per dimension that tracks 64 variables per grid point for 128 time steps yields 8~TB of data, assuming double precision. By viewing the data as a dense five-way tensor, we can compute a Tucker decomposition to find inherent low-dimensional multilinear structure, achieving compression ratios of up to 5000 on real-world data sets with negligible loss in accuracy. So that we can operate on such massive data, we present the first-ever distributed-memory parallel implementation for the Tucker decomposition, whose key computations correspond to parallel linear algebra operations, albeit with nonstandard data layouts. Our approach specifies a data distribution for tensors that avoids any tensor data redistribution, either locally or in parallel. We provide accompanying analysis of the computation and communication costs of the algorithms. To demonstrate the compression and accuracy of the method, we apply our approach to real-world data sets from combustion science simulations. We also provide detailed performance results, including parallel performance in both weak and strong scaling experiments.
In this paper, we develop software for decomposing sparse tensors that is portable to and performant on a variety of multicore, manycore, and GPU computing architectures. The result is a single code whose performance matches optimized architecture-specific implementations. The key to a portable approach is to determine multiple levels of parallelism that can be mapped in different ways to different architectures, and we explain how to do this for the matricized tensor times Khatri-Rao product (MTTKRP) which is the key kernel in canonical polyadic tensor decomposition. Our implementation leverages the Kokkos framework, which enables a single code to achieve high performance across multiple architectures that differ in how they approach fine-grained parallelism. We also introduce a new construct for portable thread-local arrays, which we call compile-time polymorphic arrays. Not only are the specifics of our approaches and implementation interesting for tuning tensor computations, but they also provide a roadmap for developing other portable high-performance codes. As a last step in optimizing performance, we modify the MTTKRP algorithm itself to do a permuted traversal of tensor nonzeros to reduce atomic-write contention. We test the performance of our implementation on 16- and 68-core Intel CPUs and the K80 and P100 NVIDIA GPUs, showing that we are competitive with state-of-the-art architecture-specific codes while having the advantage of being able to run on a variety of architectures.
Matrix and tensor operations form the basis of a wide range of fields and applications, and in many cases constitute a substantial part of the overall computational complexity. The ability of general-purpose GPUs to speed up many of these operations and enable others has resulted in a widespread adaptation of these devices. In order for tensor operations to take full advantage of the computational power, specialized software is required, and currently there exist several packages (predominantly in the area of deep learning) that incorporate tensor operations on both CPU and GPU. Nevertheless, a stand-alone framework that supports general tensor operations is still missing. In this paper we fill this gap and propose the Ocean Tensor Library: a modular tensor-support package that is designed to serve as a foundational layer for applications that require dense tensor operations on a variety of device types. The API is carefully designed to be powerful, extensible, and at the same time easy to use. The package is available as open source.
The computation of Feynman integrals often involves square roots. One way to obtain a solution in terms of multiple polylogarithms is to rationalize these square roots by a suitable variable change. We present a program that can be used to find such transformations. After an introduction to the theoretical background, we explain in detail how to use the program in practice.
Hydra is a header-only, templated and C++11-compliant framework designed to perform the typical bottleneck calculations found in common HEP data analyses on massively parallel platforms. The framework is implemented on top of the C++11 Standard Library and a variadic version of the Thrust library and is designed to run on Linux systems, using OpenMP, CUDA and TBB enabled devices. This contribution summarizes the main features of Hydra. A basic description of the overall design, functionality and user interface is provided, along with some code examples and measurements of performance.