Related papers: Portable Lattice QCD implementation based on OpenC…

We present a new set of QCD codes in both message passing and data parallel versions. The message passing package used is PARMACS, although other packages may be used. Data parallel software is written in High Performance fortran, an…

With recent developments in parallel supercomputing architecture, many core, multi-core, and GPU processors are now commonplace, resulting in more levels of parallelism, memory hierarchy, and programming complexity. It has been necessary to…

In order to achieve error rates necessary for advantageous quantum algorithms, Quantum Error Correction (QEC) will need to be employed, improving logical qubit fidelity beyond what can be achieved physically. As today's devices begin to…

Performance modeling, a pivotal domain in program cost analysis, currently relies on manually crafted models constrained by various program and hardware limitations, especially in the intricate landscape of GPGPU. Meanwhile, Large Language…

In this work we explore the performance of CUDA in quenched lattice SU(2) simulations. CUDA, NVIDIA Compute Unified Device Architecture, is a hardware and software architecture developed by NVIDIA for computing on the GPU. We present an…

Bioinformatics and Computational Biology are two fields that have been exploiting GPUs for more than two decades, being CUDA the most used programming language for them. However, as CUDA is an NVIDIA proprietary language, it implies a…

Molecular dynamics simulations are one of the methods in scientific computing that benefit from GPU acceleration. For those devices, SYCL is a promising API for writing portable codes. In this paper, we present the case study of "HAL's MD…

We developed PyQUDA, a Python wrapper for QUDA written in Cython, designed to facilitate lattice QCD calculations using the Python programming language. PyQUDA leverages the optimized linear algebra capabilities of NumPy/CuPy/PyTorch, along…

The usage of large language models (LLMs) has grown increasingly fragmented, with no single model dominating. Meanwhile, cloud providers offer a wide range of mid-tier and older-generation GPUs that enjoy better availability and deliver…

As the interest in FPGA-based accelerators for HPC applications increases, new challenges also arise, especially concerning different programming and portability issues. This paper aims to provide a snapshot of the current state of the FPGA…

The NVIDIA Collective Communication Library (NCCL) is a critical software layer enabling high-performance collectives on large-scale GPU clusters. Despite being open source with a documented API, its internal design remains largely opaque.…

NVIDIA has been the main provider of GPU hardware in HPC systems for over a decade. Most applications that benefit from GPUs have thus been developed and optimized for the NVIDIA software stack. Recent exascale HPC systems are, however,…

We introduce OpenRAND, a C++17 library aimed at facilitating reproducible scientific research through the generation of statistically robust and yet replicable random numbers. OpenRAND accommodates single and multi-threaded applications on…

QPACE is a novel massively parallel architecture optimized for lattice QCD simulations. A single QPACE node is based on the IBM PowerXCell 8i processor. The nodes are interconnected by a custom 3-dimensional torus network implemented on an…

In the past decade, high performance compute capabilities exhibited by heterogeneous GPGPU platforms have led to the popularity of data parallel programming languages such as CUDA and OpenCL. Such languages, however, involve a steep…

Hybrid computational architectures based on the joint power of Central Processing Units and Graphic Processing Units (GPUs) are becoming popular and powerful hardware tools for a wide range of simulations in biology, chemistry, engineering,…

As the complexity and size of challenges in science and engineering are continually increasing, it is highly important that applications are able to scale strongly to very large numbers of cores (>100,000 cores) to enable HPC systems to be…

This report presents a comprehensive analysis of the performance of GPU accelerated meshfree CFD solvers for two-dimensional compressible flows in Fortran, C++, Python, and Julia. The programming model CUDA is used to develop the GPU codes.…

Practical quantum advantage is expected to depend on fault-tolerant quantum computing, although the architectural overhead needed to support fault tolerance is still extremely high. Prior FTQC designs generally emphasize either fast…

In efforts to scale the size of quantum computers, modularity plays a central role across most quantum computing technologies. In the light of fault tolerance, this necessitates designing quantum error-correcting codes that are compatible…