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OLCF science articles.

water moleculesScience

Something in the Water Does Not Compute

Computational scientists at the Department of Energy’s Oak Ridge National Laboratory have published a study in the Journal of Chemical Theory and Computation that questions a long-accepted factor in simulating the molecular dynamics of water: the 2 femtosecond (one quadrillionth of a second) time step. The femtosecond is a timescale…
Coury Turczyn
May 6, 2024
RTXIndustryScienceTechnology

Summit Helps Forge Stronger Flights

Titanium alloys serve as cornerstone materials for the aerospace industry — stronger and lighter than steel, resistant to rust and corrosion and resilient past the melting points of most other metals. Companies such as RTX, formerly Raytheon Technologies, rely on these sturdy alloys to build such vital machinery as jet-engine turbine…
Matt Lakin
April 30, 2024
ScienceTechnology

Steering Toward Quantum Simulation at Scale

Researchers simulated a key quantum state at one of the largest scales reported, with support from the Quantum Computing User Program, or QCUP, at the Department of Energy’s Oak Ridge National Laboratory. The techniques used by the team could help develop quantum simulation capabilities for the next generation of quantum…
Matt Lakin
April 22, 2024
Science

New Data Processing Automation Grows Plant Science at ORNL

At the Department of Energy’s Oak Ridge National Laboratory, scientists studying plant characteristics have access to sophisticated robotic imaging tools and sensors at the Advanced Plant Phenotyping Laboratory, or APPL. This greenhouse-like lab offers one of the most diverse suites of imaging capabilities for plant phenotyping worldwide, letting scientists quickly…
Betsy Sonewald
April 15, 2024
Long shot photo of the front of the HPE Cray EX Frontier supercomputer showing the logo and electrical boxes above the system.Science

ORNL collaboration helps secure 2023 Gordon Bell Prizes

In 2023, from the Science Engagement section in the National Center for Computational Sciences at the Department of Energy’s Oak Ridge National Laboratory were recognized as part of the two teams who would go on to win the Association for Computing Machinery’s Gordon Bell Prize and the Gordon Bell Prize…
Betsy Sonewald
April 15, 2024
INCITEScience

INCITE 2025 Call for Proposals

The U.S. Department of Energy’s (DOE) Innovative and Novel Computational Impact on Theory and Experiment (INCITE) program is now accepting proposals for high-impact, computationally intensive research projects in a broad array of science, engineering and computer science domains. Proposals must be submitted between April 10 and June 14, 2024. The…
Katie Bethea
April 10, 2024
NASA Mars simulationScience

Planning for a Smooth Landing on Mars

A U.S. mission to land astronauts on the surface of Mars will be unlike any other extraterrestrial landing ever undertaken by NASA. Although the space agency has successfully landed nine robotic missions on Mars since its first surface missions in 1976 with the Viking Project, safely bringing humans to Mars…
Coury Turczyn
February 29, 2024
Exascale new frontier OLCF BannerScienceTechnology

Exascale’s New Frontier: E3SM-MMF

PI: Mark Taylor, Sandia National Laboratories In 2016, the Department of Energy’s Exascale Computing Project (ECP) set out to develop advanced software for the arrival of exascale-class supercomputers capable of a quintillion (1018) or more calculations per second. That meant rethinking, reinventing, and optimizing dozens of scientific applications and software…
Matt Lakin
January 19, 2024
Science

Fungal ‘Bouncers’ Patrol Plant-Microbe Relationship

By Stephanie Seay, ORNL A new computational framework created by Oak Ridge National Laboratory researchers is accelerating their understanding of who's in, who's out, who’s hot and who's not in the soil microbiome, where fungi often act as bodyguards for plants, keeping friends close and foes at bay. The research…
OLCF Staff Writer
January 17, 2024
Exascale new frontier OLCF BannerIndustryScienceTechnology

Exascale’s New Frontier: Combustion-Pele

PI: Jacqueline Chen, Sandia National Laboratories In 2016, the Department of Energy’s Exascale Computing Project (ECP) set out to develop advanced software for the arrival of exascale-class supercomputers capable of a quintillion (1018) or more calculations per second. That meant rethinking, reinventing, and optimizing dozens of scientific applications and software…
Matt Lakin
January 5, 2024
Exascale new frontier OLCF BannerScience

Exascale’s New Frontier: ExaSGD

PI: Christopher S. Oehmen, Pacific Northwest National Laboratory In 2016, the Department of Energy’s Exascale Computing Project (ECP) set out to develop advanced software for the arrival of exascale-class supercomputers capable of a quintillion (1018) or more calculations per second. That leap meant rethinking, reinventing, and optimizing dozens of scientific applications…
Coury Turczyn
January 5, 2024
ScienceTechnology

OLCF Announces SummitPLUS Allocations

The Department of Energy’s Oak Ridge Leadership Computing Facility has informed the recipients of high-performance computing time through the SummitPLUS allocation program, which extends the operation of the Summit supercomputer through October 2024. Over 19 million hours of compute time will be distributed among 108 projects covering the gamut of…
Coury Turczyn
December 19, 2023
Science

Custom Software Speeds Up, Stabilizes High-Profile Ocean Model

On the beach, ocean waves provide soothing white noise. But in scientific laboratories, they play a key role in weather forecasting and climate research. Along with the atmosphere, the ocean is typically one of the largest and most computationally demanding components of Earth system models like the Department of Energy’s Energy Exascale…
Elizabeth Rosenthal
December 18, 2023
moleculesScienceTechnology

ORNL Scientists Generate Molecular Datasets at Extreme Scale

A team of computational scientists at the Department of Energy’s Oak Ridge National Laboratory has generated and released datasets of unprecedented scale that provide the ultraviolet visible spectral properties of over 10 million organic molecules. Understanding how a molecule interacts with light is essential to uncovering its electronic and optical…
Coury Turczyn
December 13, 2023
Science

Frontier Search for Lightweight, Flexible Alloys Wins Gordon Bell Prize

A team of eight scientists won the Association for Computing Machinery’s 2023 Gordon Bell Prize for their study that used the world’s first exascale supercomputer to run one of the largest simulations of an alloy ever and achieve near-quantum accuracy. The ACM Gordon Bell Prize recognizes outstanding achievement in high-performance…
Matt Lakin
November 16, 2023
Science

Pulling Clouds into Focus

The world’s first exascale supercomputer will help scientists peer into the future of global climate change and open a window into weather patterns that could affect the world a generation from now. The research team used Frontier, the 1.14-exaflop HPE Cray EX supercomputer at the Department of Energy’s Oak Ridge…
Matt Lakin
November 14, 2023
Science

Big Flex for Big Science

Researchers used the world’s first exascale supercomputer to run one of the largest simulations of an alloy ever and achieve near-quantum accuracy. The study led by the University of Michigan’s Vikram Gavini employed Frontier, the 1.14-exaflop HPE Cray EX supercomputer at the Department of Energy’s Oak Ridge National Laboratory, to…
Matt Lakin
November 14, 2023
Science

Integrated Research Infrastructure at ORNL

A pathway to modern, collaborative science The Department of Energy’s Integrated Research Infrastructure aims to empower researchers to meld DOE’s world-class research tools, infrastructure, and user facilities seamlessly and securely in novel ways to radically accelerate discovery and innovation. Envisioned in 2020 and beginning implementation in 2023, IRI is designed…
OLCF Staff Writer
November 10, 2023