The performance outcomes of scientific data compression are complex in nature, often with one performance metric being more prioritized/optimized over others in the algorithm. To balance between different performance metrics, this paper formulates a new generic metric and uses it for searching an optimal configuration that leads to a balanced compression performance.

As simulation-based scientific discovery advances to exascale, a major question that the community is striving to answer is how to co-design data storage and complex physicsrich analytics in a way that the time to knowledge can be minimized for post-processing. A particular challenge is how to accommodate a broad spectrum of data analytics needsparticularly those that become clear only until very late during the post-processing, a scenario where existing methods, such as in situ processing, are unable or less effective in supporting data analytics. As HPC storage systems have become deeper and more complex with the recent addition of NVMe, die-stacked memory, and burst buffer, it requires fundamentally rethinking new paradigms and methods for data storage and analysis. This paper aims to address the issue of I/O interference for data analytics over local ephemeral storage, which is shared by multiple applications in a non-exclusive node usage scenario-often configured for small- to medium-sized clusters. At the core of this work is a coordinated cross-layer approach that reacts to storage interference from both storage and application layers. By decomposing and distributing analysis data across the storage hierarchy, data analytics can adapt to the interference by reducing or completely avoiding access to lower tiers whenever there is a high interference, while maintaining a prescribed error bound to limit the information loss. Meanwhile, proper actions are also taken at the storage layer to ensure sufficient bandwidth is allocated for retrieving an augmentation, which is based upon the cardinality and accuracy of the augmentation as well as the nature of an application. We evaluate three realworld data analytics, XGC, GenASiS, and CFD, on Chameleon, and quantitatively demonstrate that the I/O performance can be vastly improved, e.g., by 52% versus no adaptivity and 36% versus single-layer adaptivity, while maintaining acceptable outcomes of data analysis.

In this paper, we propose and evaluate the idea that data need to be preconditioned prior to compression, such that they can better match the design philosophies of lossy compressors for HPC scientific data. In particular, we aim to identify a reduced model that can be utilized to transform the original data into a more compressible form. We begin with two PDE applications as a proof of concept, in which we demonstrate that a reduced model can indeed reside in the full model output, and can be utilized to improve compression ratios. A mathematical proof is also presented to show how the compression ratio is improved by the reduced model. We further explore more general dimension reduction techniques to extract the reduced model, including principal component analysis, singular value decomposition, and discrete wavelet transform. After preconditioning, the reduced model in conjunction with difference between the reduced model and full model is stored, which results in higher compression ratios. We evaluate the reduced models on ten scientific datasets, and the results show the effectiveness of our approaches. Given that there is no single method that consistently achieves the best performance, we further propose a selection strategy that guides users to select the best reduced model prior to data reduction.

With the increasing fidelity and resolution enabled by high-performance computing systems, simulation-based scientific discovery is able to model and understand microscopic physical phenomena at a level that was not possible in the past. A grand challenge that the HPC community is faced with is how to handle the large amounts of analysis data generated from simulations. In-memory computing, among others, is recognized to be a viable path forward and has experienced tremendous success in the past decade. Nevertheless, there has been a lack of a complete study and understanding of in-memory computing as a whole on HPC systems. This paper presents a comprehensive study, which goes well beyond the typical performance metrics. In particular, we assess the in-memory computing with regard to its usability, portability, robustness and internal design trade-offs, which are the key factors that of interest to domain scientists. We use two realistic scientific workflows, LAMMPS and Laplace, to conduct comprehensive studies on state-of-the-art in-memory computing libraries, including DataSpaces, DIMES, Flexpath and Decaf. We conduct cross-platform experiments at scale on two leading supercomputers, Titan at ORNL and Cori at NERSC, and summarize our key findings in this critical area.

With the high volume and velocity of scientific data produced on high-performance computing systems, it has become increasingly critical to improve the compression performance. Leveraging the general tolerance of reduced accuracy in applications, lossy compressors can achieve much higher compression ratios with a user-prescribed error bound. However, they are still far from satisfying the reduction requirements from applications. In this paper, we propose and evaluate the idea that data need to be preconditioned prior to compression, such that they can better match the design philosophies of a compressor. In particular, we aim to identify a reduced model that can be utilized to transform the original data to a more compressible form. We begin with a case study of Heat3d as a proof of concept, in which we demonstrate that a reduced model can indeed reside in the full model output, and can be utilized to improve compression ratios. We further explore more general dimension reduction techniques to extract the reduced model, including principal component analysis, singular value decomposition, and discrete wavelet transform. After preconditioning, the reduced model in conjunction with difference between the reduced model and full model is stored, which results in higher compression ratios. We evaluate the reduced models on nine scientific datasets, and the results show the effectiveness of our approaches.