Berkeley Lab, Intel to Collaborate in Updating Scientific Codes for Manycore Architectures

June 18, 2014

June 18 — Lawrence Berkeley National Laboratory has been named an Intel Parallel Computing Center (IPCC), a collaboration with Intel aimed at adapting existing scientific applications to run on future supercomputers built with manycore processors. Such supercomputers will potentially have millions of processor cores, but today’s applications aren’t designed to take advantage of this architecture.

Most scientific applications, such as those used to study climate change, combustion, astrophysics, materials, etc., are designed to run on parallel systems, meaning that the problem is divided into smaller tasks so more of the calculations can be done simultaneously to reduce the time to solution for the scientists. With the growing use of manycore processors, such as Intel’s Xeon and Xeon Phi processors which can which can have more than 60 cores in each processor, applications will need to have even more parallelism. Unless applications are modernized, they will not be able to take advantage of the greater computing performance promised by manycore processors.

The Berkeley Lab IPCC will be led by Nick Wright of the National Energy Research Scientific Computing Center (NERSC), and Bert de Jong and Hans Johansen of the Computational Research Division (CRD).

“Although manycore processors will significantly increase supercomputing performance, that’s only part of the equation,” said Wright, who leads NERSC’s Advanced Technologies Group. “To fully capitalize on this capability, we need to modernize the applications our user community uses to advance scientific discovery. Intel Parallel Computing Centers such as ours are helping to support the community to attack this problem.”

Optimizing applications for manycore is important for NERSC, which announced in April that its next-generation supercomputer will be a Cray XC supercomputer using Intel’s next-generation Xeon Phi processor, which will have more than 60 cores. NERSC is working with its 5,000 users to help them adapt their codes to the new system, which will is expected to be delivered in 2016.

The Berkeley Lab IPCC will focus on increasing the parallelism of two widely used applications: NWChem and CAM5, the Community Atmospheric Model. NWChem is a leading application for computational chemistry and CAM5, part of the Community Earth System Model, is widely used for studying global climate. Modernizing these codes to run on manycore architecture will enable the scientific community to pursue new frontiers in the fields of chemistry, materials and climate research. Because both NWChem and CAM5 are open source applications, any improvements made to them will be shared with the broader user community, maximizing the benefits of the project.

“Enabling NWChem to harness the full power of manycore processors allows our computational chemistry and materials community to accelerate scientific discovery, tackling more complex scientific problems and reducing the time researchers have to wait for simulations to complete,” says de Jong, who leads CRD’s Scientific Computing Group and is a lead developer of the NWChem software. “Advances made by our IPCC will be shared with the developer community, including lessons learned and making our code available as open source.”

The goal is to deliver enhanced versions of NWChem and CAM5 that at least double their overall performance on manycore machines of today. The research and development will be focused upon implementing greater amounts of parallelism in the codes, starting with simple modifications such as adding or modifying existing components and going as far as exploring new algorithmic approaches that can better exploit manycore architectures.

“The open-source scientific community truly depends on CAM components running effectively at NERSC. And climate scientists have always been early adopters of cutting-edge architectures,” says Johansen, a computational science researcher at Berkeley Lab. “With more performance and more parallelism, scientists can accelerate their simulations and more accurately represent atmospheric dynamics. This collaboration with Intel will help climate science developers leverage NERSC’s and Intel’s network of resources and manycore expertise.”

Berkeley Lab is an ideal collaborator for this project. The lab is home to NERSC, the U.S. Department of Energy’s most scientifically productive supercomputing center with more than 5,000 users running about 700 different applications. CRD is home to fundamental research programs in computer science, applied mathematics, and computational science where researchers investigate future directions in scientific computing and work to develop new tools and technologies to fully exploit the increasing power of supercomputers.

According to Wright, NERSC staff will conduct extensive outreach and training to share what they have learned with NERSC’s broader user community. This will supplement the training and outreach efforts NERSC is already doing to support its users on its current flagship supercomputer “Edison,” a Cray XC30 supercomputer that uses Intel Xeon “Ivybridge” processors. Additionally, the work will be part of the NERSC’s Application Readiness program to help prepare users for the expected 2016 delivery of “Cori,” a Cray XC supercomputer architected with Intel’s next-generation Xeon Phi processor (named “Knights Landing”), which will have more than 60 cores per processor.

Berkeley Lab is the first Department of Energy laboratory to be named an IPCC. Other IPCCs are located at leading universities and research institutions around the world.

About Berkeley Lab Computing Sciences

The Lawrence Berkeley National Laboratory (Berkeley Lab) Computing Sciences organization provides the computing and networking resources and expertise critical to advancing the Department of Energy’s research missions: developing new energy sources, improving energy efficiency, developing new materials and increasing our understanding of ourselves, our world and our universe. ESnet, the Energy Sciences Network, provides the high-bandwidth, reliable connections that link scientists at 40 DOE research sites to each other and to experimental facilities and supercomputing centers around the country. The National Energy Research Scientific Computing Center (NERSC) powers the discoveries of 5,500 scientists at national laboratories and universities, including those at Berkeley Lab’s Computational Research Division (CRD). CRD conducts research and development in mathematical modeling and simulation, algorithm design, data storage, management and analysis, computer system architecture and high-performance software implementation.

Source: Lawrence Berkeley National Laboratory

Subscribe to HPCwire's Weekly Update!

Be the most informed person in the room! Stay ahead of the tech trends with industy updates delivered to you every week!

TACC Helps ROSIE Bioscience Gateway Expand its Impact

April 26, 2017

Biomolecule structure prediction has long been challenging not least because the relevant software and workflows often require high-end HPC systems that many bioscience researchers lack easy access to. Read more…

By John Russell

Messina Update: The US Path to Exascale in 16 Slides

April 26, 2017

Paul Messina, director of the U.S. Exascale Computing Project, provided a wide-ranging review of ECP’s evolving plans last week at the HPC User Forum. Read more…

By John Russell

IBM, Nvidia, Stone Ridge Claim Gas & Oil Simulation Record

April 25, 2017

IBM, Nvidia, and Stone Ridge Technology today reported setting the performance record for a “billion cell” oil and gas reservoir simulation. Read more…

By John Russell

ASC17 Makes Splash at Wuxi Supercomputing Center

April 24, 2017

A record-breaking twenty student teams plus scores of company representatives, media professionals, staff and student volunteers transformed a formerly empty hall inside the Wuxi Supercomputing Center into a bustling hub of HPC activity, kicking off day one of 2017 Asia Student Supercomputer Challenge (ASC17). Read more…

By Tiffany Trader

HPE Extreme Performance Solutions

Remote Visualization Optimizing Life Sciences Operations and Care Delivery

As patients continually demand a better quality of care and increasingly complex workloads challenge healthcare organizations to innovate, investing in the right technologies is key to ensuring growth and success. Read more…

Groq This: New AI Chips to Give GPUs a Run for Deep Learning Money

April 24, 2017

CPUs and GPUs, move over. Thanks to recent revelations surrounding Google’s new Tensor Processing Unit (TPU), the computing world appears to be on the cusp of a new generation of chips designed specifically for deep learning workloads. Read more…

By Alex Woodie

Musk’s Latest Startup Eyes Brain-Computer Links

April 21, 2017

Elon Musk, the auto and space entrepreneur and severe critic of artificial intelligence, is forming a new venture that reportedly will seek to develop an interface between the human brain and computers. Read more…

By George Leopold

MIT Mathematician Spins Up 220,000-Core Google Compute Cluster

April 21, 2017

On Thursday, Google announced that MIT math professor and computational number theorist Andrew V. Sutherland had set a record for the largest Google Compute Engine (GCE) job. Sutherland ran the massive mathematics workload on 220,000 GCE cores using preemptible virtual machine instances. Read more…

By Tiffany Trader

NERSC Cori Shows the World How Many-Cores for the Masses Works

April 21, 2017

As its mission, the high performance computing center for the U.S. Department of Energy Office of Science, NERSC (the National Energy Research Supercomputer Center), supports a broad spectrum of forefront scientific research across diverse areas that includes climate, material science, chemistry, fusion energy, high-energy physics and many others. Read more…

By Rob Farber

Messina Update: The US Path to Exascale in 16 Slides

April 26, 2017

Paul Messina, director of the U.S. Exascale Computing Project, provided a wide-ranging review of ECP’s evolving plans last week at the HPC User Forum. Read more…

By John Russell

ASC17 Makes Splash at Wuxi Supercomputing Center

April 24, 2017

A record-breaking twenty student teams plus scores of company representatives, media professionals, staff and student volunteers transformed a formerly empty hall inside the Wuxi Supercomputing Center into a bustling hub of HPC activity, kicking off day one of 2017 Asia Student Supercomputer Challenge (ASC17). Read more…

By Tiffany Trader

Groq This: New AI Chips to Give GPUs a Run for Deep Learning Money

April 24, 2017

CPUs and GPUs, move over. Thanks to recent revelations surrounding Google’s new Tensor Processing Unit (TPU), the computing world appears to be on the cusp of a new generation of chips designed specifically for deep learning workloads. Read more…

By Alex Woodie

NERSC Cori Shows the World How Many-Cores for the Masses Works

April 21, 2017

As its mission, the high performance computing center for the U.S. Department of Energy Office of Science, NERSC (the National Energy Research Supercomputer Center), supports a broad spectrum of forefront scientific research across diverse areas that includes climate, material science, chemistry, fusion energy, high-energy physics and many others. Read more…

By Rob Farber

Hyperion (IDC) Paints a Bullish Picture of HPC Future

April 20, 2017

Hyperion Research – formerly IDC’s HPC group – yesterday painted a fascinating and complicated portrait of the HPC community’s health and prospects at the HPC User Forum held in Albuquerque, NM. HPC sales are up and growing ($22 billion, all HPC segments, 2016). Read more…

By John Russell

Knights Landing Processor with Omni-Path Makes Cloud Debut

April 18, 2017

HPC cloud specialist Rescale is partnering with Intel and HPC resource provider R Systems to offer first-ever cloud access to Xeon Phi "Knights Landing" processors. The infrastructure is based on the 68-core Intel Knights Landing processor with integrated Omni-Path fabric (the 7250F Xeon Phi). Read more…

By Tiffany Trader

CERN openlab Explores New CPU/FPGA Processing Solutions

April 14, 2017

Through a CERN openlab project known as the ‘High-Throughput Computing Collaboration,’ researchers are investigating the use of various Intel technologies in data filtering and data acquisition systems. Read more…

By Linda Barney

DOE Supercomputer Achieves Record 45-Qubit Quantum Simulation

April 13, 2017

In order to simulate larger and larger quantum systems and usher in an age of “quantum supremacy,” researchers are stretching the limits of today’s most advanced supercomputers. Read more…

By Tiffany Trader

Google Pulls Back the Covers on Its First Machine Learning Chip

April 6, 2017

This week Google released a report detailing the design and performance characteristics of the Tensor Processing Unit (TPU), its custom ASIC for the inference phase of neural networks (NN). Read more…

By Tiffany Trader

Quantum Bits: D-Wave and VW; Google Quantum Lab; IBM Expands Access

March 21, 2017

For a technology that’s usually characterized as far off and in a distant galaxy, quantum computing has been steadily picking up steam. Read more…

By John Russell

Trump Budget Targets NIH, DOE, and EPA; No Mention of NSF

March 16, 2017

President Trump’s proposed U.S. fiscal 2018 budget issued today sharply cuts science spending while bolstering military spending as he promised during the campaign. Read more…

By John Russell

HPC Compiler Company PathScale Seeks Life Raft

March 23, 2017

HPCwire has learned that HPC compiler company PathScale has fallen on difficult times and is asking the community for help or actively seeking a buyer for its assets. Read more…

By Tiffany Trader

Nvidia Responds to Google TPU Benchmarking

April 10, 2017

Nvidia highlights strengths of its newest GPU silicon in response to Google's report on the performance and energy advantages of its custom tensor processor. Read more…

By Tiffany Trader

CPU-based Visualization Positions for Exascale Supercomputing

March 16, 2017

In this contributed perspective piece, Intel’s Jim Jeffers makes the case that CPU-based visualization is now widely adopted and as such is no longer a contrarian view, but is rather an exascale requirement. Read more…

By Jim Jeffers, Principal Engineer and Engineering Leader, Intel

For IBM/OpenPOWER: Success in 2017 = (Volume) Sales

January 11, 2017

To a large degree IBM and the OpenPOWER Foundation have done what they said they would – assembling a substantial and growing ecosystem and bringing Power-based products to market, all in about three years. Read more…

By John Russell

TSUBAME3.0 Points to Future HPE Pascal-NVLink-OPA Server

February 17, 2017

Since our initial coverage of the TSUBAME3.0 supercomputer yesterday, more details have come to light on this innovative project. Of particular interest is a new board design for NVLink-equipped Pascal P100 GPUs that will create another entrant to the space currently occupied by Nvidia's DGX-1 system, IBM's "Minsky" platform and the Supermicro SuperServer (1028GQ-TXR). Read more…

By Tiffany Trader

Leading Solution Providers

Tokyo Tech’s TSUBAME3.0 Will Be First HPE-SGI Super

February 16, 2017

In a press event Friday afternoon local time in Japan, Tokyo Institute of Technology (Tokyo Tech) announced its plans for the TSUBAME3.0 supercomputer, which will be Japan’s “fastest AI supercomputer,” Read more…

By Tiffany Trader

Is Liquid Cooling Ready to Go Mainstream?

February 13, 2017

Lost in the frenzy of SC16 was a substantial rise in the number of vendors showing server oriented liquid cooling technologies. Three decades ago liquid cooling was pretty much the exclusive realm of the Cray-2 and IBM mainframe class products. That’s changing. We are now seeing an emergence of x86 class server products with exotic plumbing technology ranging from Direct-to-Chip to servers and storage completely immersed in a dielectric fluid. Read more…

By Steve Campbell

IBM Wants to be “Red Hat” of Deep Learning

January 26, 2017

IBM today announced the addition of TensorFlow and Chainer deep learning frameworks to its PowerAI suite of deep learning tools, which already includes popular offerings such as Caffe, Theano, and Torch. Read more…

By John Russell

Facebook Open Sources Caffe2; Nvidia, Intel Rush to Optimize

April 18, 2017

From its F8 developer conference in San Jose, Calif., today, Facebook announced Caffe2, a new open-source, cross-platform framework for deep learning. Caffe2 is the successor to Caffe, the deep learning framework developed by Berkeley AI Research and community contributors. Read more…

By Tiffany Trader

BioTeam’s Berman Charts 2017 HPC Trends in Life Sciences

January 4, 2017

Twenty years ago high performance computing was nearly absent from life sciences. Today it’s used throughout life sciences and biomedical research. Genomics and the data deluge from modern lab instruments are the main drivers, but so is the longer-term desire to perform predictive simulation in support of Precision Medicine (PM). There’s even a specialized life sciences supercomputer, ‘Anton’ from D.E. Shaw Research, and the Pittsburgh Supercomputing Center is standing up its second Anton 2 and actively soliciting project proposals. There’s a lot going on. Read more…

By John Russell

HPC Startup Advances Auto-Parallelization’s Promise

January 23, 2017

The shift from single core to multicore hardware has made finding parallelism in codes more important than ever, but that hasn’t made the task of parallel programming any easier. Read more…

By Tiffany Trader

HPC Technique Propels Deep Learning at Scale

February 21, 2017

Researchers from Baidu’s Silicon Valley AI Lab (SVAIL) have adapted a well-known HPC communication technique to boost the speed and scale of their neural network training and now they are sharing their implementation with the larger deep learning community. Read more…

By Tiffany Trader

IDG to Be Bought by Chinese Investors; IDC to Spin Out HPC Group

January 19, 2017

US-based publishing and investment firm International Data Group, Inc. (IDG) will be acquired by a pair of Chinese investors, China Oceanwide Holdings Group Co., Ltd. Read more…

By Tiffany Trader

  • arrow
  • Click Here for More Headlines
  • arrow
Share This